data_9K8Z
# 
_entry.id   9K8Z 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.402 
_audit_conform.dict_location   http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic 
# 
loop_
_database_2.database_id 
_database_2.database_code 
_database_2.pdbx_database_accession 
_database_2.pdbx_DOI 
PDB   9K8Z         pdb_00009k8z 10.2210/pdb9k8z/pdb 
WWPDB D_1300052983 ?            ?                   
# 
loop_
_pdbx_audit_revision_history.ordinal 
_pdbx_audit_revision_history.data_content_type 
_pdbx_audit_revision_history.major_revision 
_pdbx_audit_revision_history.minor_revision 
_pdbx_audit_revision_history.revision_date 
_pdbx_audit_revision_history.part_number 
1 'Structure model' 1 0 2025-02-19 ? 
2 'Structure model' 1 1 2025-02-26 ? 
3 'Structure model' 1 2 2025-03-12 ? 
# 
_pdbx_audit_revision_details.ordinal             1 
_pdbx_audit_revision_details.revision_ordinal    1 
_pdbx_audit_revision_details.data_content_type   'Structure model' 
_pdbx_audit_revision_details.provider            repository 
_pdbx_audit_revision_details.type                'Initial release' 
_pdbx_audit_revision_details.description         ? 
_pdbx_audit_revision_details.details             ? 
# 
loop_
_pdbx_audit_revision_group.ordinal 
_pdbx_audit_revision_group.revision_ordinal 
_pdbx_audit_revision_group.data_content_type 
_pdbx_audit_revision_group.group 
1 2 'Structure model' 'Structure summary'   
2 3 'Structure model' 'Database references' 
# 
loop_
_pdbx_audit_revision_category.ordinal 
_pdbx_audit_revision_category.revision_ordinal 
_pdbx_audit_revision_category.data_content_type 
_pdbx_audit_revision_category.category 
1 2 'Structure model' struct   
2 3 'Structure model' citation 
# 
loop_
_pdbx_audit_revision_item.ordinal 
_pdbx_audit_revision_item.revision_ordinal 
_pdbx_audit_revision_item.data_content_type 
_pdbx_audit_revision_item.item 
1 2 'Structure model' '_struct.title'            
2 3 'Structure model' '_citation.journal_volume' 
3 3 'Structure model' '_citation.page_first'     
4 3 'Structure model' '_citation.page_last'      
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        9K8Z 
_pdbx_database_status.recvd_initial_deposition_date   2024-10-25 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    PDBJ 
_pdbx_database_status.process_site                    PDBJ 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.status_code_nmr_data            ? 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           Y 
# 
_pdbx_database_related.db_name        PDB 
_pdbx_database_related.details        . 
_pdbx_database_related.db_id          9K7R 
_pdbx_database_related.content_type   unspecified 
# 
_pdbx_contact_author.id                 2 
_pdbx_contact_author.email              j.kondo@sophia.ac.jp 
_pdbx_contact_author.name_first         Jiro 
_pdbx_contact_author.name_last          Kondo 
_pdbx_contact_author.name_mi            ? 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0002-5682-3685 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Kondo, J.' 1 0000-0002-5682-3685 
'Ando, S.'  2 ?                   
# 
_citation.abstract                  ? 
_citation.abstract_id_CAS           ? 
_citation.book_id_ISBN              ? 
_citation.book_publisher            ? 
_citation.book_publisher_city       ? 
_citation.book_title                ? 
_citation.coordinate_linkage        ? 
_citation.country                   US 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            'Acta Crystallogr.,Sect.F' 
_citation.journal_id_ASTM           ACSFEN 
_citation.journal_id_CSD            ? 
_citation.journal_id_ISSN           2053-230X 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            81 
_citation.language                  ? 
_citation.page_first                95 
_citation.page_last                 100 
_citation.title                     'The first report of structural analysis of a nucleic acid using crystals grown in space.' 
_citation.year                      2025 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      10.1107/S2053230X25000810 
_citation.pdbx_database_id_PubMed   39937045 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Ando, S.'      1 ? 
primary 'Takahashi, M.' 2 ? 
primary 'Kondo, J.'     3 ? 
# 
loop_
_entity.id 
_entity.type 
_entity.src_method 
_entity.pdbx_description 
_entity.formula_weight 
_entity.pdbx_number_of_molecules 
_entity.pdbx_ec 
_entity.pdbx_mutation 
_entity.pdbx_fragment 
_entity.details 
1 polymer     syn 
;RNA (5'-R(*GP*AP*AP*GP*AP*AP*GP*AP*G)-3')
;
2981.895 1  ? ? ? ? 
2 polymer     syn 
;DNA (5'-D(*(5CM)P*TP*CP*TP*TP*CP*TP*TP*(5CM))-3')
;
2660.788 1  ? ? ? ? 
3 non-polymer syn SPERMINE                                            202.340  1  ? ? ? ? 
4 water       nat water                                               18.015   74 ? ? ? ? 
# 
loop_
_entity_poly.entity_id 
_entity_poly.type 
_entity_poly.nstd_linkage 
_entity_poly.nstd_monomer 
_entity_poly.pdbx_seq_one_letter_code 
_entity_poly.pdbx_seq_one_letter_code_can 
_entity_poly.pdbx_strand_id 
_entity_poly.pdbx_target_identifier 
1 polyribonucleotide      no no  GAAGAAGAG                                GAAGAAGAG A ? 
2 polydeoxyribonucleotide no yes '(5CM)(DT)(DC)(DT)(DT)(DC)(DT)(DT)(5CM)' CTCTTCTTC B ? 
# 
loop_
_pdbx_entity_nonpoly.entity_id 
_pdbx_entity_nonpoly.name 
_pdbx_entity_nonpoly.comp_id 
3 SPERMINE SPM 
4 water    HOH 
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1 G   n 
1 2 A   n 
1 3 A   n 
1 4 G   n 
1 5 A   n 
1 6 A   n 
1 7 G   n 
1 8 A   n 
1 9 G   n 
2 1 5CM n 
2 2 DT  n 
2 3 DC  n 
2 4 DT  n 
2 5 DT  n 
2 6 DC  n 
2 7 DT  n 
2 8 DT  n 
2 9 5CM n 
# 
loop_
_pdbx_entity_src_syn.entity_id 
_pdbx_entity_src_syn.pdbx_src_id 
_pdbx_entity_src_syn.pdbx_alt_source_flag 
_pdbx_entity_src_syn.pdbx_beg_seq_num 
_pdbx_entity_src_syn.pdbx_end_seq_num 
_pdbx_entity_src_syn.organism_scientific 
_pdbx_entity_src_syn.organism_common_name 
_pdbx_entity_src_syn.ncbi_taxonomy_id 
_pdbx_entity_src_syn.details 
1 1 sample 1 9 'synthetic construct' ? 32630 ? 
2 1 sample 1 9 'synthetic construct' ? 32630 ? 
# 
loop_
_chem_comp.id 
_chem_comp.type 
_chem_comp.mon_nstd_flag 
_chem_comp.name 
_chem_comp.pdbx_synonyms 
_chem_comp.formula 
_chem_comp.formula_weight 
5CM 'DNA linking' n "5-METHYL-2'-DEOXY-CYTIDINE-5'-MONOPHOSPHATE" ? 'C10 H16 N3 O7 P' 321.224 
A   'RNA linking' y "ADENOSINE-5'-MONOPHOSPHATE"                  ? 'C10 H14 N5 O7 P' 347.221 
DC  'DNA linking' y "2'-DEOXYCYTIDINE-5'-MONOPHOSPHATE"           ? 'C9 H14 N3 O7 P'  307.197 
DT  'DNA linking' y "THYMIDINE-5'-MONOPHOSPHATE"                  ? 'C10 H15 N2 O8 P' 322.208 
G   'RNA linking' y "GUANOSINE-5'-MONOPHOSPHATE"                  ? 'C10 H14 N5 O8 P' 363.221 
HOH non-polymer   . WATER                                         ? 'H2 O'            18.015  
SPM non-polymer   . SPERMINE                                      ? 'C10 H26 N4'      202.340 
# 
loop_
_pdbx_poly_seq_scheme.asym_id 
_pdbx_poly_seq_scheme.entity_id 
_pdbx_poly_seq_scheme.seq_id 
_pdbx_poly_seq_scheme.mon_id 
_pdbx_poly_seq_scheme.ndb_seq_num 
_pdbx_poly_seq_scheme.pdb_seq_num 
_pdbx_poly_seq_scheme.auth_seq_num 
_pdbx_poly_seq_scheme.pdb_mon_id 
_pdbx_poly_seq_scheme.auth_mon_id 
_pdbx_poly_seq_scheme.pdb_strand_id 
_pdbx_poly_seq_scheme.pdb_ins_code 
_pdbx_poly_seq_scheme.hetero 
A 1 1 G   1 1 1 G   G   A . n 
A 1 2 A   2 2 2 A   A   A . n 
A 1 3 A   3 3 3 A   A   A . n 
A 1 4 G   4 4 4 G   G   A . n 
A 1 5 A   5 5 5 A   A   A . n 
A 1 6 A   6 6 6 A   A   A . n 
A 1 7 G   7 7 7 G   G   A . n 
A 1 8 A   8 8 8 A   A   A . n 
A 1 9 G   9 9 9 G   G   A . n 
B 2 1 5CM 1 1 1 5CM 5CM B . n 
B 2 2 DT  2 2 2 DT  DT  B . n 
B 2 3 DC  3 3 3 DC  DC  B . n 
B 2 4 DT  4 4 4 DT  DT  B . n 
B 2 5 DT  5 5 5 DT  DT  B . n 
B 2 6 DC  6 6 6 DC  DC  B . n 
B 2 7 DT  7 7 7 DT  DT  B . n 
B 2 8 DT  8 8 8 DT  DT  B . n 
B 2 9 5CM 9 9 9 5CM 5CM B . n 
# 
loop_
_pdbx_nonpoly_scheme.asym_id 
_pdbx_nonpoly_scheme.entity_id 
_pdbx_nonpoly_scheme.mon_id 
_pdbx_nonpoly_scheme.ndb_seq_num 
_pdbx_nonpoly_scheme.pdb_seq_num 
_pdbx_nonpoly_scheme.auth_seq_num 
_pdbx_nonpoly_scheme.pdb_mon_id 
_pdbx_nonpoly_scheme.auth_mon_id 
_pdbx_nonpoly_scheme.pdb_strand_id 
_pdbx_nonpoly_scheme.pdb_ins_code 
C 3 SPM 1  101 83 SPM SPM B . 
D 4 HOH 1  101 27 HOH HOH A . 
D 4 HOH 2  102 19 HOH HOH A . 
D 4 HOH 3  103 68 HOH HOH A . 
D 4 HOH 4  104 37 HOH HOH A . 
D 4 HOH 5  105 77 HOH HOH A . 
D 4 HOH 6  106 71 HOH HOH A . 
D 4 HOH 7  107 14 HOH HOH A . 
D 4 HOH 8  108 20 HOH HOH A . 
D 4 HOH 9  109 48 HOH HOH A . 
D 4 HOH 10 110 6  HOH HOH A . 
D 4 HOH 11 111 23 HOH HOH A . 
D 4 HOH 12 112 54 HOH HOH A . 
D 4 HOH 13 113 47 HOH HOH A . 
D 4 HOH 14 114 50 HOH HOH A . 
D 4 HOH 15 115 7  HOH HOH A . 
D 4 HOH 16 116 82 HOH HOH A . 
D 4 HOH 17 117 61 HOH HOH A . 
D 4 HOH 18 118 1  HOH HOH A . 
D 4 HOH 19 119 2  HOH HOH A . 
D 4 HOH 20 120 69 HOH HOH A . 
D 4 HOH 21 121 80 HOH HOH A . 
D 4 HOH 22 122 31 HOH HOH A . 
D 4 HOH 23 123 73 HOH HOH A . 
D 4 HOH 24 124 30 HOH HOH A . 
D 4 HOH 25 125 35 HOH HOH A . 
D 4 HOH 26 126 38 HOH HOH A . 
D 4 HOH 27 127 65 HOH HOH A . 
D 4 HOH 28 128 58 HOH HOH A . 
D 4 HOH 29 129 46 HOH HOH A . 
D 4 HOH 30 130 75 HOH HOH A . 
D 4 HOH 31 131 70 HOH HOH A . 
E 4 HOH 1  201 49 HOH HOH B . 
E 4 HOH 2  202 28 HOH HOH B . 
E 4 HOH 3  203 44 HOH HOH B . 
E 4 HOH 4  204 53 HOH HOH B . 
E 4 HOH 5  205 32 HOH HOH B . 
E 4 HOH 6  206 36 HOH HOH B . 
E 4 HOH 7  207 29 HOH HOH B . 
E 4 HOH 8  208 59 HOH HOH B . 
E 4 HOH 9  209 4  HOH HOH B . 
E 4 HOH 10 210 15 HOH HOH B . 
E 4 HOH 11 211 8  HOH HOH B . 
E 4 HOH 12 212 51 HOH HOH B . 
E 4 HOH 13 213 21 HOH HOH B . 
E 4 HOH 14 214 13 HOH HOH B . 
E 4 HOH 15 215 52 HOH HOH B . 
E 4 HOH 16 216 3  HOH HOH B . 
E 4 HOH 17 217 10 HOH HOH B . 
E 4 HOH 18 218 39 HOH HOH B . 
E 4 HOH 19 219 17 HOH HOH B . 
E 4 HOH 20 220 18 HOH HOH B . 
E 4 HOH 21 221 72 HOH HOH B . 
E 4 HOH 22 222 40 HOH HOH B . 
E 4 HOH 23 223 74 HOH HOH B . 
E 4 HOH 24 224 60 HOH HOH B . 
E 4 HOH 25 225 25 HOH HOH B . 
E 4 HOH 26 226 42 HOH HOH B . 
E 4 HOH 27 227 5  HOH HOH B . 
E 4 HOH 28 228 43 HOH HOH B . 
E 4 HOH 29 229 41 HOH HOH B . 
E 4 HOH 30 230 57 HOH HOH B . 
E 4 HOH 31 231 34 HOH HOH B . 
E 4 HOH 32 232 12 HOH HOH B . 
E 4 HOH 33 233 11 HOH HOH B . 
E 4 HOH 34 234 26 HOH HOH B . 
E 4 HOH 35 235 56 HOH HOH B . 
E 4 HOH 36 236 62 HOH HOH B . 
E 4 HOH 37 237 45 HOH HOH B . 
E 4 HOH 38 238 55 HOH HOH B . 
E 4 HOH 39 239 63 HOH HOH B . 
E 4 HOH 40 240 79 HOH HOH B . 
E 4 HOH 41 241 66 HOH HOH B . 
E 4 HOH 42 242 78 HOH HOH B . 
E 4 HOH 43 243 76 HOH HOH B . 
# 
loop_
_software.citation_id 
_software.classification 
_software.compiler_name 
_software.compiler_version 
_software.contact_author 
_software.contact_author_email 
_software.date 
_software.description 
_software.dependencies 
_software.hardware 
_software.language 
_software.location 
_software.mods 
_software.name 
_software.os 
_software.os_version 
_software.type 
_software.version 
_software.pdbx_ordinal 
? refinement       ? ? ? ? ? ? ? ? ? ? ? PHENIX ? ? ? '(1.20.1_4487: ???)' 1 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? XSCALE ? ? ? .                    2 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? XDS    ? ? ? .                    3 
? phasing          ? ? ? ? ? ? ? ? ? ? ? PHASER ? ? ? .                    4 
# 
_cell.angle_alpha                  90.00 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   90.00 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  120.00 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     9K8Z 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     48.656 
_cell.length_a_esd                 ? 
_cell.length_b                     48.656 
_cell.length_b_esd                 ? 
_cell.length_c                     45.738 
_cell.length_c_esd                 ? 
_cell.volume                       ? 
_cell.volume_esd                   ? 
_cell.Z_PDB                        6 
_cell.reciprocal_angle_alpha       ? 
_cell.reciprocal_angle_beta        ? 
_cell.reciprocal_angle_gamma       ? 
_cell.reciprocal_angle_alpha_esd   ? 
_cell.reciprocal_angle_beta_esd    ? 
_cell.reciprocal_angle_gamma_esd   ? 
_cell.reciprocal_length_a          ? 
_cell.reciprocal_length_b          ? 
_cell.reciprocal_length_c          ? 
_cell.reciprocal_length_a_esd      ? 
_cell.reciprocal_length_b_esd      ? 
_cell.reciprocal_length_c_esd      ? 
_cell.pdbx_unique_axis             ? 
_cell.pdbx_esd_method              ? 
# 
_symmetry.entry_id                         9K8Z 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                169 
_symmetry.space_group_name_Hall            ? 
_symmetry.space_group_name_H-M             'P 61' 
_symmetry.pdbx_full_space_group_name_H-M   ? 
# 
_exptl.absorpt_coefficient_mu     ? 
_exptl.absorpt_correction_T_max   ? 
_exptl.absorpt_correction_T_min   ? 
_exptl.absorpt_correction_type    ? 
_exptl.absorpt_process_details    ? 
_exptl.entry_id                   9K8Z 
_exptl.crystals_number            1 
_exptl.details                    ? 
_exptl.method                     'X-RAY DIFFRACTION' 
_exptl.method_details             ? 
# 
_exptl_crystal.colour                       ? 
_exptl_crystal.density_diffrn               ? 
_exptl_crystal.density_Matthews             2.77 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          55.59 
_exptl_crystal.description                  ? 
_exptl_crystal.F_000                        ? 
_exptl_crystal.id                           1 
_exptl_crystal.preparation                  ? 
_exptl_crystal.size_max                     ? 
_exptl_crystal.size_mid                     ? 
_exptl_crystal.size_min                     ? 
_exptl_crystal.size_rad                     ? 
_exptl_crystal.colour_lustre                ? 
_exptl_crystal.colour_modifier              ? 
_exptl_crystal.colour_primary               ? 
_exptl_crystal.density_meas                 ? 
_exptl_crystal.density_meas_esd             ? 
_exptl_crystal.density_meas_gt              ? 
_exptl_crystal.density_meas_lt              ? 
_exptl_crystal.density_meas_temp            ? 
_exptl_crystal.density_meas_temp_esd        ? 
_exptl_crystal.density_meas_temp_gt         ? 
_exptl_crystal.density_meas_temp_lt         ? 
_exptl_crystal.pdbx_crystal_image_url       ? 
_exptl_crystal.pdbx_crystal_image_format    ? 
_exptl_crystal.pdbx_mosaicity               ? 
_exptl_crystal.pdbx_mosaicity_esd           ? 
_exptl_crystal.pdbx_mosaic_method           ? 
_exptl_crystal.pdbx_mosaic_block_size       ? 
_exptl_crystal.pdbx_mosaic_block_size_esd   ? 
# 
_exptl_crystal_grow.apparatus       ? 
_exptl_crystal_grow.atmosphere      ? 
_exptl_crystal_grow.crystal_id      1 
_exptl_crystal_grow.details         ? 
_exptl_crystal_grow.method          COUNTER-DIFFUSION 
_exptl_crystal_grow.method_ref      ? 
_exptl_crystal_grow.pH              ? 
_exptl_crystal_grow.pressure        ? 
_exptl_crystal_grow.pressure_esd    ? 
_exptl_crystal_grow.seeding         ? 
_exptl_crystal_grow.seeding_ref     ? 
_exptl_crystal_grow.temp_details    ? 
_exptl_crystal_grow.temp_esd        ? 
_exptl_crystal_grow.time            ? 
_exptl_crystal_grow.pdbx_details    'potassium chloride, MPD, spermine, MES' 
_exptl_crystal_grow.pdbx_pH_range   ? 
_exptl_crystal_grow.temp            293.15 
# 
_diffrn.ambient_environment              ? 
_diffrn.ambient_temp                     100 
_diffrn.ambient_temp_details             ? 
_diffrn.ambient_temp_esd                 ? 
_diffrn.crystal_id                       1 
_diffrn.crystal_support                  ? 
_diffrn.crystal_treatment                ? 
_diffrn.details                          ? 
_diffrn.id                               1 
_diffrn.ambient_pressure                 ? 
_diffrn.ambient_pressure_esd             ? 
_diffrn.ambient_pressure_gt              ? 
_diffrn.ambient_pressure_lt              ? 
_diffrn.ambient_temp_gt                  ? 
_diffrn.ambient_temp_lt                  ? 
_diffrn.pdbx_serial_crystal_experiment   N 
# 
_diffrn_detector.details                      ? 
_diffrn_detector.detector                     PIXEL 
_diffrn_detector.diffrn_id                    1 
_diffrn_detector.type                         'DECTRIS EIGER X 16M' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2024-03-24 
_diffrn_detector.pdbx_frequency               ? 
_diffrn_detector.id                           ? 
_diffrn_detector.number_of_axes               ? 
# 
_diffrn_radiation.collimation                      ? 
_diffrn_radiation.diffrn_id                        1 
_diffrn_radiation.filter_edge                      ? 
_diffrn_radiation.inhomogeneity                    ? 
_diffrn_radiation.monochromator                    ? 
_diffrn_radiation.polarisn_norm                    ? 
_diffrn_radiation.polarisn_ratio                   ? 
_diffrn_radiation.probe                            ? 
_diffrn_radiation.type                             ? 
_diffrn_radiation.xray_symbol                      ? 
_diffrn_radiation.wavelength_id                    1 
_diffrn_radiation.pdbx_monochromatic_or_laue_m_l   M 
_diffrn_radiation.pdbx_wavelength_list             ? 
_diffrn_radiation.pdbx_wavelength                  ? 
_diffrn_radiation.pdbx_diffrn_protocol             'SINGLE WAVELENGTH' 
_diffrn_radiation.pdbx_analyzer                    ? 
_diffrn_radiation.pdbx_scattering_type             x-ray 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   0.98 
_diffrn_radiation_wavelength.wt           1.0 
# 
_diffrn_source.current                     ? 
_diffrn_source.details                     ? 
_diffrn_source.diffrn_id                   1 
_diffrn_source.power                       ? 
_diffrn_source.size                        ? 
_diffrn_source.source                      SYNCHROTRON 
_diffrn_source.target                      ? 
_diffrn_source.type                        'PHOTON FACTORY BEAMLINE BL-17A' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        0.98 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   BL-17A 
_diffrn_source.pdbx_synchrotron_site       'Photon Factory' 
# 
_reflns.B_iso_Wilson_estimate                          ? 
_reflns.entry_id                                       9K8Z 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.40 
_reflns.d_resolution_low                               24.33 
_reflns.details                                        ? 
_reflns.limit_h_max                                    ? 
_reflns.limit_h_min                                    ? 
_reflns.limit_k_max                                    ? 
_reflns.limit_k_min                                    ? 
_reflns.limit_l_max                                    ? 
_reflns.limit_l_min                                    ? 
_reflns.number_all                                     ? 
_reflns.number_obs                                     12207 
_reflns.observed_criterion                             ? 
_reflns.observed_criterion_F_max                       ? 
_reflns.observed_criterion_F_min                       ? 
_reflns.observed_criterion_I_max                       ? 
_reflns.observed_criterion_I_min                       ? 
_reflns.observed_criterion_sigma_F                     ? 
_reflns.observed_criterion_sigma_I                     ? 
_reflns.percent_possible_obs                           99.9 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                5.5 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          20.74 
_reflns.pdbx_res_netI_over_av_sigmaI_2                 ? 
_reflns.pdbx_res_netI_over_sigmaI_2                    ? 
_reflns.pdbx_chi_squared                               ? 
_reflns.pdbx_scaling_rejects                           ? 
_reflns.pdbx_d_res_high_opt                            ? 
_reflns.pdbx_d_res_low_opt                             ? 
_reflns.pdbx_d_res_opt_method                          ? 
_reflns.phase_calculation_details                      ? 
_reflns.pdbx_Rrim_I_all                                0.042 
_reflns.pdbx_Rpim_I_all                                ? 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       ? 
_reflns.pdbx_diffrn_id                                 1 
_reflns.pdbx_ordinal                                   1 
_reflns.pdbx_CC_half                                   0.999 
_reflns.pdbx_CC_star                                   ? 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_Rmerge_I_obs                              0.038 
_reflns.pdbx_Rmerge_I_all                              ? 
_reflns.pdbx_Rsym_value                                ? 
_reflns.pdbx_CC_split_method                           ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_1                 ? 
_reflns.pdbx_aniso_diffraction_limit_2                 ? 
_reflns.pdbx_aniso_diffraction_limit_3                 ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_1               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_2               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_3               ? 
_reflns.pdbx_orthogonalization_convention              ? 
_reflns.pdbx_percent_possible_ellipsoidal              ? 
_reflns.pdbx_percent_possible_spherical                ? 
_reflns.pdbx_percent_possible_ellipsoidal_anomalous    ? 
_reflns.pdbx_percent_possible_spherical_anomalous      ? 
_reflns.pdbx_redundancy_anomalous                      ? 
_reflns.pdbx_CC_half_anomalous                         ? 
_reflns.pdbx_absDiff_over_sigma_anomalous              ? 
_reflns.pdbx_percent_possible_anomalous                ? 
_reflns.pdbx_observed_signal_threshold                 ? 
_reflns.pdbx_signal_type                               ? 
_reflns.pdbx_signal_details                            ? 
_reflns.pdbx_signal_software_id                        ? 
# 
loop_
_reflns_shell.d_res_high 
_reflns_shell.d_res_low 
_reflns_shell.meanI_over_sigI_all 
_reflns_shell.meanI_over_sigI_obs 
_reflns_shell.number_measured_all 
_reflns_shell.number_measured_obs 
_reflns_shell.number_possible 
_reflns_shell.number_unique_all 
_reflns_shell.number_unique_obs 
_reflns_shell.percent_possible_obs 
_reflns_shell.Rmerge_F_all 
_reflns_shell.Rmerge_F_obs 
_reflns_shell.meanI_over_sigI_gt 
_reflns_shell.meanI_over_uI_all 
_reflns_shell.meanI_over_uI_gt 
_reflns_shell.number_measured_gt 
_reflns_shell.number_unique_gt 
_reflns_shell.percent_possible_gt 
_reflns_shell.Rmerge_F_gt 
_reflns_shell.Rmerge_I_gt 
_reflns_shell.pdbx_redundancy 
_reflns_shell.pdbx_chi_squared 
_reflns_shell.pdbx_netI_over_sigmaI_all 
_reflns_shell.pdbx_netI_over_sigmaI_obs 
_reflns_shell.pdbx_Rrim_I_all 
_reflns_shell.pdbx_Rpim_I_all 
_reflns_shell.pdbx_rejects 
_reflns_shell.pdbx_ordinal 
_reflns_shell.pdbx_diffrn_id 
_reflns_shell.pdbx_CC_half 
_reflns_shell.pdbx_CC_star 
_reflns_shell.pdbx_R_split 
_reflns_shell.percent_possible_all 
_reflns_shell.Rmerge_I_all 
_reflns_shell.Rmerge_I_obs 
_reflns_shell.pdbx_Rsym_value 
_reflns_shell.pdbx_percent_possible_ellipsoidal 
_reflns_shell.pdbx_percent_possible_spherical 
_reflns_shell.pdbx_percent_possible_ellipsoidal_anomalous 
_reflns_shell.pdbx_percent_possible_spherical_anomalous 
_reflns_shell.pdbx_redundancy_anomalous 
_reflns_shell.pdbx_CC_half_anomalous 
_reflns_shell.pdbx_absDiff_over_sigma_anomalous 
_reflns_shell.pdbx_percent_possible_anomalous 
1.43 1.44  ? ? ? ? ? ? 222  ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.386 ? ? 1  1 0.93  ? ? ? ? 0.351 ? ? ? ? ? ? ? ? ? 
1.44 1.45  ? ? ? ? ? ? 246  ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.429 ? ? 2  1 0.915 ? ? ? ? 0.389 ? ? ? ? ? ? ? ? ? 
1.45 1.46  ? ? ? ? ? ? 207  ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.399 ? ? 3  1 0.91  ? ? ? ? 0.362 ? ? ? ? ? ? ? ? ? 
1.46 1.47  ? ? ? ? ? ? 231  ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.426 ? ? 4  1 0.904 ? ? ? ? 0.386 ? ? ? ? ? ? ? ? ? 
1.47 1.5   ? ? ? ? ? ? 614  ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.297 ? ? 5  1 0.946 ? ? ? ? 0.27  ? ? ? ? ? ? ? ? ? 
1.50 1.6   ? ? ? ? ? ? 1717 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.22  ? ? 6  1 0.976 ? ? ? ? 0.199 ? ? ? ? ? ? ? ? ? 
1.60 2.0   ? ? ? ? ? ? 3991 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.087 ? ? 7  1 0.996 ? ? ? ? 0.078 ? ? ? ? ? ? ? ? ? 
2.00 3.0   ? ? ? ? ? ? 2944 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.048 ? ? 8  1 0.999 ? ? ? ? 0.043 ? ? ? ? ? ? ? ? ? 
3.00 4.0   ? ? ? ? ? ? 733  ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.035 ? ? 9  1 0.999 ? ? ? ? 0.032 ? ? ? ? ? ? ? ? ? 
4.00 5.0   ? ? ? ? ? ? 253  ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.033 ? ? 10 1 0.998 ? ? ? ? 0.03  ? ? ? ? ? ? ? ? ? 
5.00 24.33 ? ? ? ? ? ? 285  ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.028 ? ? 11 1 0.999 ? ? ? ? 0.025 ? ? ? ? ? ? ? ? ? 
# 
_refine.aniso_B[1][1]                            ? 
_refine.aniso_B[1][2]                            ? 
_refine.aniso_B[1][3]                            ? 
_refine.aniso_B[2][2]                            ? 
_refine.aniso_B[2][3]                            ? 
_refine.aniso_B[3][3]                            ? 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               ? 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               ? 
_refine.correlation_coeff_Fo_to_Fc_free          ? 
_refine.details                                  ? 
_refine.diff_density_max                         ? 
_refine.diff_density_max_esd                     ? 
_refine.diff_density_min                         ? 
_refine.diff_density_min_esd                     ? 
_refine.diff_density_rms                         ? 
_refine.diff_density_rms_esd                     ? 
_refine.entry_id                                 9K8Z 
_refine.pdbx_refine_id                           'X-RAY DIFFRACTION' 
_refine.ls_abs_structure_details                 ? 
_refine.ls_abs_structure_Flack                   ? 
_refine.ls_abs_structure_Flack_esd               ? 
_refine.ls_abs_structure_Rogers                  ? 
_refine.ls_abs_structure_Rogers_esd              ? 
_refine.ls_d_res_high                            1.40 
_refine.ls_d_res_low                             24.33 
_refine.ls_extinction_coef                       ? 
_refine.ls_extinction_coef_esd                   ? 
_refine.ls_extinction_expression                 ? 
_refine.ls_extinction_method                     ? 
_refine.ls_goodness_of_fit_all                   ? 
_refine.ls_goodness_of_fit_all_esd               ? 
_refine.ls_goodness_of_fit_obs                   ? 
_refine.ls_goodness_of_fit_obs_esd               ? 
_refine.ls_hydrogen_treatment                    ? 
_refine.ls_matrix_type                           ? 
_refine.ls_number_constraints                    ? 
_refine.ls_number_parameters                     ? 
_refine.ls_number_reflns_all                     ? 
_refine.ls_number_reflns_obs                     12207 
_refine.ls_number_reflns_R_free                  1236 
_refine.ls_number_reflns_R_work                  ? 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    99.71 
_refine.ls_percent_reflns_R_free                 10.13 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.1862 
_refine.ls_R_factor_R_free                       0.1957 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.1851 
_refine.ls_R_Fsqd_factor_obs                     ? 
_refine.ls_R_I_factor_obs                        ? 
_refine.ls_redundancy_reflns_all                 ? 
_refine.ls_redundancy_reflns_obs                 ? 
_refine.ls_restrained_S_all                      ? 
_refine.ls_restrained_S_obs                      ? 
_refine.ls_shift_over_esd_max                    ? 
_refine.ls_shift_over_esd_mean                   ? 
_refine.ls_structure_factor_coef                 ? 
_refine.ls_weighting_details                     ? 
_refine.ls_weighting_scheme                      ? 
_refine.ls_wR_factor_all                         ? 
_refine.ls_wR_factor_obs                         ? 
_refine.ls_wR_factor_R_free                      ? 
_refine.ls_wR_factor_R_work                      ? 
_refine.occupancy_max                            ? 
_refine.occupancy_min                            ? 
_refine.solvent_model_details                    'FLAT BULK SOLVENT MODEL' 
_refine.solvent_model_param_bsol                 ? 
_refine.solvent_model_param_ksol                 ? 
_refine.pdbx_R_complete                          ? 
_refine.ls_R_factor_gt                           ? 
_refine.ls_goodness_of_fit_gt                    ? 
_refine.ls_goodness_of_fit_ref                   ? 
_refine.ls_shift_over_su_max                     ? 
_refine.ls_shift_over_su_max_lt                  ? 
_refine.ls_shift_over_su_mean                    ? 
_refine.ls_shift_over_su_mean_lt                 ? 
_refine.pdbx_ls_sigma_I                          ? 
_refine.pdbx_ls_sigma_F                          1.40 
_refine.pdbx_ls_sigma_Fsqd                       ? 
_refine.pdbx_data_cutoff_high_absF               ? 
_refine.pdbx_data_cutoff_high_rms_absF           ? 
_refine.pdbx_data_cutoff_low_absF                ? 
_refine.pdbx_isotropic_thermal_model             ? 
_refine.pdbx_ls_cross_valid_method               'FREE R-VALUE' 
_refine.pdbx_method_to_determine_struct          'MOLECULAR REPLACEMENT' 
_refine.pdbx_starting_model                      4U6M 
_refine.pdbx_stereochemistry_target_values       ML 
_refine.pdbx_R_Free_selection_details            ? 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_overall_ESU_R                       ? 
_refine.pdbx_overall_ESU_R_Free                  ? 
_refine.pdbx_solvent_vdw_probe_radii             1.10 
_refine.pdbx_solvent_ion_probe_radii             ? 
_refine.pdbx_solvent_shrinkage_radii             0.90 
_refine.pdbx_real_space_R                        ? 
_refine.pdbx_density_correlation                 ? 
_refine.pdbx_pd_number_of_powder_patterns        ? 
_refine.pdbx_pd_number_of_points                 ? 
_refine.pdbx_pd_meas_number_of_points            ? 
_refine.pdbx_pd_proc_ls_prof_R_factor            ? 
_refine.pdbx_pd_proc_ls_prof_wR_factor           ? 
_refine.pdbx_pd_Marquardt_correlation_coeff      ? 
_refine.pdbx_pd_Fsqrd_R_factor                   ? 
_refine.pdbx_pd_ls_matrix_band_width             ? 
_refine.pdbx_overall_phase_error                 25.41 
_refine.pdbx_overall_SU_R_free_Cruickshank_DPI   ? 
_refine.pdbx_overall_SU_R_free_Blow_DPI          ? 
_refine.pdbx_overall_SU_R_Blow_DPI               ? 
_refine.pdbx_TLS_residual_ADP_flag               ? 
_refine.pdbx_diffrn_id                           1 
_refine.overall_SU_B                             ? 
_refine.overall_SU_ML                            0.15 
_refine.overall_SU_R_Cruickshank_DPI             ? 
_refine.overall_SU_R_free                        ? 
_refine.overall_FOM_free_R_set                   ? 
_refine.overall_FOM_work_R_set                   ? 
_refine.pdbx_average_fsc_overall                 ? 
_refine.pdbx_average_fsc_work                    ? 
_refine.pdbx_average_fsc_free                    ? 
# 
_refine_hist.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_hist.cycle_id                         LAST 
_refine_hist.details                          ? 
_refine_hist.d_res_high                       1.40 
_refine_hist.d_res_low                        24.33 
_refine_hist.number_atoms_solvent             74 
_refine_hist.number_atoms_total               462 
_refine_hist.number_reflns_all                ? 
_refine_hist.number_reflns_obs                ? 
_refine_hist.number_reflns_R_free             ? 
_refine_hist.number_reflns_R_work             ? 
_refine_hist.R_factor_all                     ? 
_refine_hist.R_factor_obs                     ? 
_refine_hist.R_factor_R_free                  ? 
_refine_hist.R_factor_R_work                  ? 
_refine_hist.pdbx_number_residues_total       ? 
_refine_hist.pdbx_B_iso_mean_ligand           ? 
_refine_hist.pdbx_B_iso_mean_solvent          ? 
_refine_hist.pdbx_number_atoms_protein        0 
_refine_hist.pdbx_number_atoms_nucleic_acid   374 
_refine_hist.pdbx_number_atoms_ligand         14 
_refine_hist.pdbx_number_atoms_lipid          ? 
_refine_hist.pdbx_number_atoms_carb           ? 
_refine_hist.pdbx_pseudo_atom_details         ? 
# 
loop_
_refine_ls_restr.pdbx_refine_id 
_refine_ls_restr.criterion 
_refine_ls_restr.dev_ideal 
_refine_ls_restr.dev_ideal_target 
_refine_ls_restr.number 
_refine_ls_restr.rejects 
_refine_ls_restr.type 
_refine_ls_restr.weight 
_refine_ls_restr.pdbx_restraint_function 
'X-RAY DIFFRACTION' ? 0.006  ? ?   ? f_bond_d           ? ? 
'X-RAY DIFFRACTION' ? 1.037  ? ?   ? f_angle_d          ? ? 
'X-RAY DIFFRACTION' ? 10.619 ? 189 ? f_dihedral_angle_d ? ? 
'X-RAY DIFFRACTION' ? 0.038  ? 78  ? f_chiral_restr     ? ? 
'X-RAY DIFFRACTION' ? 0.008  ? 18  ? f_plane_restr      ? ? 
# 
loop_
_refine_ls_shell.pdbx_refine_id 
_refine_ls_shell.d_res_high 
_refine_ls_shell.d_res_low 
_refine_ls_shell.number_reflns_all 
_refine_ls_shell.number_reflns_obs 
_refine_ls_shell.number_reflns_R_free 
_refine_ls_shell.number_reflns_R_work 
_refine_ls_shell.percent_reflns_obs 
_refine_ls_shell.percent_reflns_R_free 
_refine_ls_shell.R_factor_all 
_refine_ls_shell.R_factor_obs 
_refine_ls_shell.R_factor_R_free_error 
_refine_ls_shell.R_factor_R_work 
_refine_ls_shell.redundancy_reflns_all 
_refine_ls_shell.redundancy_reflns_obs 
_refine_ls_shell.wR_factor_all 
_refine_ls_shell.wR_factor_obs 
_refine_ls_shell.wR_factor_R_free 
_refine_ls_shell.wR_factor_R_work 
_refine_ls_shell.pdbx_R_complete 
_refine_ls_shell.pdbx_total_number_of_bins_used 
_refine_ls_shell.pdbx_phase_error 
_refine_ls_shell.pdbx_fsc_work 
_refine_ls_shell.pdbx_fsc_free 
_refine_ls_shell.R_factor_R_free 
'X-RAY DIFFRACTION' 1.40 1.45  . . 140 1192 98.00  . . . . 0.2620 . . . . . . . . . . . 0.2587 
'X-RAY DIFFRACTION' 1.45 1.52  . . 140 1225 100.00 . . . . 0.2300 . . . . . . . . . . . 0.2622 
'X-RAY DIFFRACTION' 1.52 1.60  . . 132 1188 100.00 . . . . 0.2184 . . . . . . . . . . . 0.2474 
'X-RAY DIFFRACTION' 1.60 1.70  . . 137 1222 100.00 . . . . 0.2188 . . . . . . . . . . . 0.2284 
'X-RAY DIFFRACTION' 1.70 1.83  . . 139 1222 100.00 . . . . 0.2045 . . . . . . . . . . . 0.2255 
'X-RAY DIFFRACTION' 1.83 2.02  . . 139 1216 100.00 . . . . 0.2077 . . . . . . . . . . . 0.2441 
'X-RAY DIFFRACTION' 2.02 2.31  . . 140 1227 100.00 . . . . 0.2097 . . . . . . . . . . . 0.2101 
'X-RAY DIFFRACTION' 2.31 2.91  . . 132 1234 100.00 . . . . 0.2093 . . . . . . . . . . . 0.2077 
'X-RAY DIFFRACTION' 2.91 24.33 . . 137 1245 100.00 . . . . 0.1455 . . . . . . . . . . . 0.1538 
# 
_struct.entry_id                     9K8Z 
_struct.title                        
'Crystal structure of DNA/RNA duplex obtained using the counter diffusion method in space (K form)' 
_struct.pdbx_model_details           ? 
_struct.pdbx_formula_weight          ? 
_struct.pdbx_formula_weight_method   ? 
_struct.pdbx_model_type_details      ? 
_struct.pdbx_CASP_flag               N 
# 
_struct_keywords.entry_id        9K8Z 
_struct_keywords.text            'counter diffusion method, space, microgravity, RNA-DNA complex' 
_struct_keywords.pdbx_keywords   RNA/DNA 
# 
loop_
_struct_asym.id 
_struct_asym.pdbx_blank_PDB_chainid_flag 
_struct_asym.pdbx_modified 
_struct_asym.entity_id 
_struct_asym.details 
A N N 1 ? 
B N N 2 ? 
C N N 3 ? 
D N N 4 ? 
E N N 4 ? 
# 
loop_
_struct_ref.id 
_struct_ref.db_name 
_struct_ref.db_code 
_struct_ref.pdbx_db_accession 
_struct_ref.pdbx_db_isoform 
_struct_ref.entity_id 
_struct_ref.pdbx_seq_one_letter_code 
_struct_ref.pdbx_align_begin 
1 PDB 9K8Z 9K8Z ? 1 ? 1 
2 PDB 9K8Z 9K8Z ? 2 ? 1 
# 
loop_
_struct_ref_seq.align_id 
_struct_ref_seq.ref_id 
_struct_ref_seq.pdbx_PDB_id_code 
_struct_ref_seq.pdbx_strand_id 
_struct_ref_seq.seq_align_beg 
_struct_ref_seq.pdbx_seq_align_beg_ins_code 
_struct_ref_seq.seq_align_end 
_struct_ref_seq.pdbx_seq_align_end_ins_code 
_struct_ref_seq.pdbx_db_accession 
_struct_ref_seq.db_align_beg 
_struct_ref_seq.pdbx_db_align_beg_ins_code 
_struct_ref_seq.db_align_end 
_struct_ref_seq.pdbx_db_align_end_ins_code 
_struct_ref_seq.pdbx_auth_seq_align_beg 
_struct_ref_seq.pdbx_auth_seq_align_end 
1 1 9K8Z A 1 ? 9 ? 9K8Z 1 ? 9 ? 1 9 
2 2 9K8Z B 1 ? 9 ? 9K8Z 1 ? 9 ? 1 9 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_and_software_defined_assembly 
_pdbx_struct_assembly.method_details       PISA 
_pdbx_struct_assembly.oligomeric_details   dimeric 
_pdbx_struct_assembly.oligomeric_count     2 
# 
loop_
_pdbx_struct_assembly_prop.biol_id 
_pdbx_struct_assembly_prop.type 
_pdbx_struct_assembly_prop.value 
_pdbx_struct_assembly_prop.details 
1 'ABSA (A^2)' 1700 ? 
1 MORE         -2   ? 
1 'SSA (A^2)'  3490 ? 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1 
_pdbx_struct_assembly_gen.asym_id_list      A,B,C,D,E 
# 
_pdbx_struct_assembly_auth_evidence.id                     1 
_pdbx_struct_assembly_auth_evidence.assembly_id            1 
_pdbx_struct_assembly_auth_evidence.experimental_support   none 
_pdbx_struct_assembly_auth_evidence.details                ? 
# 
_pdbx_struct_oper_list.id                   1 
_pdbx_struct_oper_list.type                 'identity operation' 
_pdbx_struct_oper_list.name                 1_555 
_pdbx_struct_oper_list.symmetry_operation   x,y,z 
_pdbx_struct_oper_list.matrix[1][1]         1.0000000000 
_pdbx_struct_oper_list.matrix[1][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[1][3]         0.0000000000 
_pdbx_struct_oper_list.vector[1]            0.0000000000 
_pdbx_struct_oper_list.matrix[2][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[2][2]         1.0000000000 
_pdbx_struct_oper_list.matrix[2][3]         0.0000000000 
_pdbx_struct_oper_list.vector[2]            0.0000000000 
_pdbx_struct_oper_list.matrix[3][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][3]         1.0000000000 
_pdbx_struct_oper_list.vector[3]            0.0000000000 
# 
loop_
_struct_conn.id 
_struct_conn.conn_type_id 
_struct_conn.pdbx_leaving_atom_flag 
_struct_conn.pdbx_PDB_id 
_struct_conn.ptnr1_label_asym_id 
_struct_conn.ptnr1_label_comp_id 
_struct_conn.ptnr1_label_seq_id 
_struct_conn.ptnr1_label_atom_id 
_struct_conn.pdbx_ptnr1_label_alt_id 
_struct_conn.pdbx_ptnr1_PDB_ins_code 
_struct_conn.pdbx_ptnr1_standard_comp_id 
_struct_conn.ptnr1_symmetry 
_struct_conn.ptnr2_label_asym_id 
_struct_conn.ptnr2_label_comp_id 
_struct_conn.ptnr2_label_seq_id 
_struct_conn.ptnr2_label_atom_id 
_struct_conn.pdbx_ptnr2_label_alt_id 
_struct_conn.pdbx_ptnr2_PDB_ins_code 
_struct_conn.ptnr1_auth_asym_id 
_struct_conn.ptnr1_auth_comp_id 
_struct_conn.ptnr1_auth_seq_id 
_struct_conn.ptnr2_auth_asym_id 
_struct_conn.ptnr2_auth_comp_id 
_struct_conn.ptnr2_auth_seq_id 
_struct_conn.ptnr2_symmetry 
_struct_conn.pdbx_ptnr3_label_atom_id 
_struct_conn.pdbx_ptnr3_label_seq_id 
_struct_conn.pdbx_ptnr3_label_comp_id 
_struct_conn.pdbx_ptnr3_label_asym_id 
_struct_conn.pdbx_ptnr3_label_alt_id 
_struct_conn.pdbx_ptnr3_PDB_ins_code 
_struct_conn.details 
_struct_conn.pdbx_dist_value 
_struct_conn.pdbx_value_order 
_struct_conn.pdbx_role 
covale1  covale both ? B 5CM 1 "O3'" ? ? ? 1_555 B DT  2 P  ? ? B 5CM 1 B DT  2 1_555 ? ? ? ? ? ? ?            1.609 ? ? 
covale2  covale both ? B DT  8 "O3'" ? ? ? 1_555 B 5CM 9 P  ? ? B DT  8 B 5CM 9 1_555 ? ? ? ? ? ? ?            1.605 ? ? 
hydrog1  hydrog ?    ? A G   1 N1    ? ? ? 1_555 B 5CM 9 N3 ? ? A G   1 B 5CM 9 1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? ? 
hydrog2  hydrog ?    ? A G   1 N2    ? ? ? 1_555 B 5CM 9 O2 ? ? A G   1 B 5CM 9 1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? ? 
hydrog3  hydrog ?    ? A G   1 O6    ? ? ? 1_555 B 5CM 9 N4 ? ? A G   1 B 5CM 9 1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? ? 
hydrog4  hydrog ?    ? A A   2 N1    ? ? ? 1_555 B DT  8 N3 ? ? A A   2 B DT  8 1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? ? 
hydrog5  hydrog ?    ? A A   2 N6    ? ? ? 1_555 B DT  8 O4 ? ? A A   2 B DT  8 1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? ? 
hydrog6  hydrog ?    ? A A   3 N1    ? ? ? 1_555 B DT  7 N3 ? ? A A   3 B DT  7 1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? ? 
hydrog7  hydrog ?    ? A A   3 N6    ? ? ? 1_555 B DT  7 O4 ? ? A A   3 B DT  7 1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? ? 
hydrog8  hydrog ?    ? A G   4 N1    ? ? ? 1_555 B DC  6 N3 ? ? A G   4 B DC  6 1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? ? 
hydrog9  hydrog ?    ? A G   4 N2    ? ? ? 1_555 B DC  6 O2 ? ? A G   4 B DC  6 1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? ? 
hydrog10 hydrog ?    ? A G   4 O6    ? ? ? 1_555 B DC  6 N4 ? ? A G   4 B DC  6 1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? ? 
hydrog11 hydrog ?    ? A A   5 N1    ? ? ? 1_555 B DT  5 N3 ? ? A A   5 B DT  5 1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? ? 
hydrog12 hydrog ?    ? A A   5 N6    ? ? ? 1_555 B DT  5 O4 ? ? A A   5 B DT  5 1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? ? 
hydrog13 hydrog ?    ? A A   6 N1    ? ? ? 1_555 B DT  4 N3 ? ? A A   6 B DT  4 1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? ? 
hydrog14 hydrog ?    ? A A   6 N6    ? ? ? 1_555 B DT  4 O4 ? ? A A   6 B DT  4 1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? ? 
hydrog15 hydrog ?    ? A G   7 N1    ? ? ? 1_555 B DC  3 N3 ? ? A G   7 B DC  3 1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? ? 
hydrog16 hydrog ?    ? A G   7 N2    ? ? ? 1_555 B DC  3 O2 ? ? A G   7 B DC  3 1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? ? 
hydrog17 hydrog ?    ? A G   7 O6    ? ? ? 1_555 B DC  3 N4 ? ? A G   7 B DC  3 1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? ? 
hydrog18 hydrog ?    ? A A   8 N1    ? ? ? 1_555 B DT  2 N3 ? ? A A   8 B DT  2 1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? ? 
hydrog19 hydrog ?    ? A A   8 N6    ? ? ? 1_555 B DT  2 O4 ? ? A A   8 B DT  2 1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? ? 
hydrog20 hydrog ?    ? A G   9 N1    ? ? ? 1_555 B 5CM 1 N3 ? ? A G   9 B 5CM 1 1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? ? 
hydrog21 hydrog ?    ? A G   9 N2    ? ? ? 1_555 B 5CM 1 O2 ? ? A G   9 B 5CM 1 1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? ? 
hydrog22 hydrog ?    ? A G   9 O6    ? ? ? 1_555 B 5CM 1 N4 ? ? A G   9 B 5CM 1 1_555 ? ? ? ? ? ? WATSON-CRICK ?     ? ? 
# 
loop_
_struct_conn_type.id 
_struct_conn_type.criteria 
_struct_conn_type.reference 
covale ? ? 
hydrog ? ? 
# 
_pdbx_entry_details.entry_id                   9K8Z 
_pdbx_entry_details.nonpolymer_details         ? 
_pdbx_entry_details.sequence_details           ? 
_pdbx_entry_details.compound_details           ? 
_pdbx_entry_details.source_details             ? 
_pdbx_entry_details.has_ligand_of_interest     N 
_pdbx_entry_details.has_protein_modification   N 
# 
loop_
_chem_comp_atom.comp_id 
_chem_comp_atom.atom_id 
_chem_comp_atom.type_symbol 
_chem_comp_atom.pdbx_aromatic_flag 
_chem_comp_atom.pdbx_stereo_config 
_chem_comp_atom.pdbx_ordinal 
5CM N1     N N N 1   
5CM C2     C N N 2   
5CM N3     N N N 3   
5CM C4     C N N 4   
5CM C5     C N N 5   
5CM C5A    C N N 6   
5CM C6     C N N 7   
5CM O2     O N N 8   
5CM N4     N N N 9   
5CM "C1'"  C N R 10  
5CM "C2'"  C N N 11  
5CM "C3'"  C N S 12  
5CM "C4'"  C N R 13  
5CM "O4'"  O N N 14  
5CM "O3'"  O N N 15  
5CM "C5'"  C N N 16  
5CM "O5'"  O N N 17  
5CM P      P N N 18  
5CM OP1    O N N 19  
5CM OP2    O N N 20  
5CM OP3    O N N 21  
5CM H5A1   H N N 22  
5CM H5A2   H N N 23  
5CM H5A3   H N N 24  
5CM H6     H N N 25  
5CM HN41   H N N 26  
5CM HN42   H N N 27  
5CM "H1'"  H N N 28  
5CM "H2'"  H N N 29  
5CM "H2''" H N N 30  
5CM "H3'"  H N N 31  
5CM "H4'"  H N N 32  
5CM "HO3'" H N N 33  
5CM "H5'"  H N N 34  
5CM "H5''" H N N 35  
5CM HOP2   H N N 36  
5CM HOP3   H N N 37  
A   OP3    O N N 38  
A   P      P N N 39  
A   OP1    O N N 40  
A   OP2    O N N 41  
A   "O5'"  O N N 42  
A   "C5'"  C N N 43  
A   "C4'"  C N R 44  
A   "O4'"  O N N 45  
A   "C3'"  C N S 46  
A   "O3'"  O N N 47  
A   "C2'"  C N R 48  
A   "O2'"  O N N 49  
A   "C1'"  C N R 50  
A   N9     N Y N 51  
A   C8     C Y N 52  
A   N7     N Y N 53  
A   C5     C Y N 54  
A   C6     C Y N 55  
A   N6     N N N 56  
A   N1     N Y N 57  
A   C2     C Y N 58  
A   N3     N Y N 59  
A   C4     C Y N 60  
A   HOP3   H N N 61  
A   HOP2   H N N 62  
A   "H5'"  H N N 63  
A   "H5''" H N N 64  
A   "H4'"  H N N 65  
A   "H3'"  H N N 66  
A   "HO3'" H N N 67  
A   "H2'"  H N N 68  
A   "HO2'" H N N 69  
A   "H1'"  H N N 70  
A   H8     H N N 71  
A   H61    H N N 72  
A   H62    H N N 73  
A   H2     H N N 74  
DC  OP3    O N N 75  
DC  P      P N N 76  
DC  OP1    O N N 77  
DC  OP2    O N N 78  
DC  "O5'"  O N N 79  
DC  "C5'"  C N N 80  
DC  "C4'"  C N R 81  
DC  "O4'"  O N N 82  
DC  "C3'"  C N S 83  
DC  "O3'"  O N N 84  
DC  "C2'"  C N N 85  
DC  "C1'"  C N R 86  
DC  N1     N N N 87  
DC  C2     C N N 88  
DC  O2     O N N 89  
DC  N3     N N N 90  
DC  C4     C N N 91  
DC  N4     N N N 92  
DC  C5     C N N 93  
DC  C6     C N N 94  
DC  HOP3   H N N 95  
DC  HOP2   H N N 96  
DC  "H5'"  H N N 97  
DC  "H5''" H N N 98  
DC  "H4'"  H N N 99  
DC  "H3'"  H N N 100 
DC  "HO3'" H N N 101 
DC  "H2'"  H N N 102 
DC  "H2''" H N N 103 
DC  "H1'"  H N N 104 
DC  H41    H N N 105 
DC  H42    H N N 106 
DC  H5     H N N 107 
DC  H6     H N N 108 
DT  OP3    O N N 109 
DT  P      P N N 110 
DT  OP1    O N N 111 
DT  OP2    O N N 112 
DT  "O5'"  O N N 113 
DT  "C5'"  C N N 114 
DT  "C4'"  C N R 115 
DT  "O4'"  O N N 116 
DT  "C3'"  C N S 117 
DT  "O3'"  O N N 118 
DT  "C2'"  C N N 119 
DT  "C1'"  C N R 120 
DT  N1     N N N 121 
DT  C2     C N N 122 
DT  O2     O N N 123 
DT  N3     N N N 124 
DT  C4     C N N 125 
DT  O4     O N N 126 
DT  C5     C N N 127 
DT  C7     C N N 128 
DT  C6     C N N 129 
DT  HOP3   H N N 130 
DT  HOP2   H N N 131 
DT  "H5'"  H N N 132 
DT  "H5''" H N N 133 
DT  "H4'"  H N N 134 
DT  "H3'"  H N N 135 
DT  "HO3'" H N N 136 
DT  "H2'"  H N N 137 
DT  "H2''" H N N 138 
DT  "H1'"  H N N 139 
DT  H3     H N N 140 
DT  H71    H N N 141 
DT  H72    H N N 142 
DT  H73    H N N 143 
DT  H6     H N N 144 
G   OP3    O N N 145 
G   P      P N N 146 
G   OP1    O N N 147 
G   OP2    O N N 148 
G   "O5'"  O N N 149 
G   "C5'"  C N N 150 
G   "C4'"  C N R 151 
G   "O4'"  O N N 152 
G   "C3'"  C N S 153 
G   "O3'"  O N N 154 
G   "C2'"  C N R 155 
G   "O2'"  O N N 156 
G   "C1'"  C N R 157 
G   N9     N Y N 158 
G   C8     C Y N 159 
G   N7     N Y N 160 
G   C5     C Y N 161 
G   C6     C N N 162 
G   O6     O N N 163 
G   N1     N N N 164 
G   C2     C N N 165 
G   N2     N N N 166 
G   N3     N N N 167 
G   C4     C Y N 168 
G   HOP3   H N N 169 
G   HOP2   H N N 170 
G   "H5'"  H N N 171 
G   "H5''" H N N 172 
G   "H4'"  H N N 173 
G   "H3'"  H N N 174 
G   "HO3'" H N N 175 
G   "H2'"  H N N 176 
G   "HO2'" H N N 177 
G   "H1'"  H N N 178 
G   H8     H N N 179 
G   H1     H N N 180 
G   H21    H N N 181 
G   H22    H N N 182 
HOH O      O N N 183 
HOH H1     H N N 184 
HOH H2     H N N 185 
SPM N1     N N N 186 
SPM C2     C N N 187 
SPM C3     C N N 188 
SPM C4     C N N 189 
SPM N5     N N N 190 
SPM C6     C N N 191 
SPM C7     C N N 192 
SPM C8     C N N 193 
SPM C9     C N N 194 
SPM N10    N N N 195 
SPM C11    C N N 196 
SPM C12    C N N 197 
SPM C13    C N N 198 
SPM N14    N N N 199 
SPM HN11   H N N 200 
SPM HN12   H N N 201 
SPM H21    H N N 202 
SPM H22    H N N 203 
SPM H31    H N N 204 
SPM H32    H N N 205 
SPM H41    H N N 206 
SPM H42    H N N 207 
SPM HN5    H N N 208 
SPM H61    H N N 209 
SPM H62    H N N 210 
SPM H71    H N N 211 
SPM H72    H N N 212 
SPM H81    H N N 213 
SPM H82    H N N 214 
SPM H91    H N N 215 
SPM H92    H N N 216 
SPM HN0    H N N 217 
SPM H111   H N N 218 
SPM H112   H N N 219 
SPM H121   H N N 220 
SPM H122   H N N 221 
SPM H131   H N N 222 
SPM H132   H N N 223 
SPM HN41   H N N 224 
SPM HN42   H N N 225 
# 
loop_
_chem_comp_bond.comp_id 
_chem_comp_bond.atom_id_1 
_chem_comp_bond.atom_id_2 
_chem_comp_bond.value_order 
_chem_comp_bond.pdbx_aromatic_flag 
_chem_comp_bond.pdbx_stereo_config 
_chem_comp_bond.pdbx_ordinal 
5CM N1    C2     sing N N 1   
5CM N1    C6     sing N N 2   
5CM N1    "C1'"  sing N N 3   
5CM C2    N3     sing N N 4   
5CM C2    O2     doub N N 5   
5CM N3    C4     doub N N 6   
5CM C4    C5     sing N N 7   
5CM C4    N4     sing N N 8   
5CM C5    C5A    sing N N 9   
5CM C5    C6     doub N N 10  
5CM C5A   H5A1   sing N N 11  
5CM C5A   H5A2   sing N N 12  
5CM C5A   H5A3   sing N N 13  
5CM C6    H6     sing N N 14  
5CM N4    HN41   sing N N 15  
5CM N4    HN42   sing N N 16  
5CM "C1'" "C2'"  sing N N 17  
5CM "C1'" "O4'"  sing N N 18  
5CM "C1'" "H1'"  sing N N 19  
5CM "C2'" "C3'"  sing N N 20  
5CM "C2'" "H2'"  sing N N 21  
5CM "C2'" "H2''" sing N N 22  
5CM "C3'" "C4'"  sing N N 23  
5CM "C3'" "O3'"  sing N N 24  
5CM "C3'" "H3'"  sing N N 25  
5CM "C4'" "O4'"  sing N N 26  
5CM "C4'" "C5'"  sing N N 27  
5CM "C4'" "H4'"  sing N N 28  
5CM "O3'" "HO3'" sing N N 29  
5CM "C5'" "O5'"  sing N N 30  
5CM "C5'" "H5'"  sing N N 31  
5CM "C5'" "H5''" sing N N 32  
5CM "O5'" P      sing N N 33  
5CM P     OP1    doub N N 34  
5CM P     OP2    sing N N 35  
5CM P     OP3    sing N N 36  
5CM OP2   HOP2   sing N N 37  
5CM OP3   HOP3   sing N N 38  
A   OP3   P      sing N N 39  
A   OP3   HOP3   sing N N 40  
A   P     OP1    doub N N 41  
A   P     OP2    sing N N 42  
A   P     "O5'"  sing N N 43  
A   OP2   HOP2   sing N N 44  
A   "O5'" "C5'"  sing N N 45  
A   "C5'" "C4'"  sing N N 46  
A   "C5'" "H5'"  sing N N 47  
A   "C5'" "H5''" sing N N 48  
A   "C4'" "O4'"  sing N N 49  
A   "C4'" "C3'"  sing N N 50  
A   "C4'" "H4'"  sing N N 51  
A   "O4'" "C1'"  sing N N 52  
A   "C3'" "O3'"  sing N N 53  
A   "C3'" "C2'"  sing N N 54  
A   "C3'" "H3'"  sing N N 55  
A   "O3'" "HO3'" sing N N 56  
A   "C2'" "O2'"  sing N N 57  
A   "C2'" "C1'"  sing N N 58  
A   "C2'" "H2'"  sing N N 59  
A   "O2'" "HO2'" sing N N 60  
A   "C1'" N9     sing N N 61  
A   "C1'" "H1'"  sing N N 62  
A   N9    C8     sing Y N 63  
A   N9    C4     sing Y N 64  
A   C8    N7     doub Y N 65  
A   C8    H8     sing N N 66  
A   N7    C5     sing Y N 67  
A   C5    C6     sing Y N 68  
A   C5    C4     doub Y N 69  
A   C6    N6     sing N N 70  
A   C6    N1     doub Y N 71  
A   N6    H61    sing N N 72  
A   N6    H62    sing N N 73  
A   N1    C2     sing Y N 74  
A   C2    N3     doub Y N 75  
A   C2    H2     sing N N 76  
A   N3    C4     sing Y N 77  
DC  OP3   P      sing N N 78  
DC  OP3   HOP3   sing N N 79  
DC  P     OP1    doub N N 80  
DC  P     OP2    sing N N 81  
DC  P     "O5'"  sing N N 82  
DC  OP2   HOP2   sing N N 83  
DC  "O5'" "C5'"  sing N N 84  
DC  "C5'" "C4'"  sing N N 85  
DC  "C5'" "H5'"  sing N N 86  
DC  "C5'" "H5''" sing N N 87  
DC  "C4'" "O4'"  sing N N 88  
DC  "C4'" "C3'"  sing N N 89  
DC  "C4'" "H4'"  sing N N 90  
DC  "O4'" "C1'"  sing N N 91  
DC  "C3'" "O3'"  sing N N 92  
DC  "C3'" "C2'"  sing N N 93  
DC  "C3'" "H3'"  sing N N 94  
DC  "O3'" "HO3'" sing N N 95  
DC  "C2'" "C1'"  sing N N 96  
DC  "C2'" "H2'"  sing N N 97  
DC  "C2'" "H2''" sing N N 98  
DC  "C1'" N1     sing N N 99  
DC  "C1'" "H1'"  sing N N 100 
DC  N1    C2     sing N N 101 
DC  N1    C6     sing N N 102 
DC  C2    O2     doub N N 103 
DC  C2    N3     sing N N 104 
DC  N3    C4     doub N N 105 
DC  C4    N4     sing N N 106 
DC  C4    C5     sing N N 107 
DC  N4    H41    sing N N 108 
DC  N4    H42    sing N N 109 
DC  C5    C6     doub N N 110 
DC  C5    H5     sing N N 111 
DC  C6    H6     sing N N 112 
DT  OP3   P      sing N N 113 
DT  OP3   HOP3   sing N N 114 
DT  P     OP1    doub N N 115 
DT  P     OP2    sing N N 116 
DT  P     "O5'"  sing N N 117 
DT  OP2   HOP2   sing N N 118 
DT  "O5'" "C5'"  sing N N 119 
DT  "C5'" "C4'"  sing N N 120 
DT  "C5'" "H5'"  sing N N 121 
DT  "C5'" "H5''" sing N N 122 
DT  "C4'" "O4'"  sing N N 123 
DT  "C4'" "C3'"  sing N N 124 
DT  "C4'" "H4'"  sing N N 125 
DT  "O4'" "C1'"  sing N N 126 
DT  "C3'" "O3'"  sing N N 127 
DT  "C3'" "C2'"  sing N N 128 
DT  "C3'" "H3'"  sing N N 129 
DT  "O3'" "HO3'" sing N N 130 
DT  "C2'" "C1'"  sing N N 131 
DT  "C2'" "H2'"  sing N N 132 
DT  "C2'" "H2''" sing N N 133 
DT  "C1'" N1     sing N N 134 
DT  "C1'" "H1'"  sing N N 135 
DT  N1    C2     sing N N 136 
DT  N1    C6     sing N N 137 
DT  C2    O2     doub N N 138 
DT  C2    N3     sing N N 139 
DT  N3    C4     sing N N 140 
DT  N3    H3     sing N N 141 
DT  C4    O4     doub N N 142 
DT  C4    C5     sing N N 143 
DT  C5    C7     sing N N 144 
DT  C5    C6     doub N N 145 
DT  C7    H71    sing N N 146 
DT  C7    H72    sing N N 147 
DT  C7    H73    sing N N 148 
DT  C6    H6     sing N N 149 
G   OP3   P      sing N N 150 
G   OP3   HOP3   sing N N 151 
G   P     OP1    doub N N 152 
G   P     OP2    sing N N 153 
G   P     "O5'"  sing N N 154 
G   OP2   HOP2   sing N N 155 
G   "O5'" "C5'"  sing N N 156 
G   "C5'" "C4'"  sing N N 157 
G   "C5'" "H5'"  sing N N 158 
G   "C5'" "H5''" sing N N 159 
G   "C4'" "O4'"  sing N N 160 
G   "C4'" "C3'"  sing N N 161 
G   "C4'" "H4'"  sing N N 162 
G   "O4'" "C1'"  sing N N 163 
G   "C3'" "O3'"  sing N N 164 
G   "C3'" "C2'"  sing N N 165 
G   "C3'" "H3'"  sing N N 166 
G   "O3'" "HO3'" sing N N 167 
G   "C2'" "O2'"  sing N N 168 
G   "C2'" "C1'"  sing N N 169 
G   "C2'" "H2'"  sing N N 170 
G   "O2'" "HO2'" sing N N 171 
G   "C1'" N9     sing N N 172 
G   "C1'" "H1'"  sing N N 173 
G   N9    C8     sing Y N 174 
G   N9    C4     sing Y N 175 
G   C8    N7     doub Y N 176 
G   C8    H8     sing N N 177 
G   N7    C5     sing Y N 178 
G   C5    C6     sing N N 179 
G   C5    C4     doub Y N 180 
G   C6    O6     doub N N 181 
G   C6    N1     sing N N 182 
G   N1    C2     sing N N 183 
G   N1    H1     sing N N 184 
G   C2    N2     sing N N 185 
G   C2    N3     doub N N 186 
G   N2    H21    sing N N 187 
G   N2    H22    sing N N 188 
G   N3    C4     sing N N 189 
HOH O     H1     sing N N 190 
HOH O     H2     sing N N 191 
SPM N1    C2     sing N N 192 
SPM N1    HN11   sing N N 193 
SPM N1    HN12   sing N N 194 
SPM C2    C3     sing N N 195 
SPM C2    H21    sing N N 196 
SPM C2    H22    sing N N 197 
SPM C3    C4     sing N N 198 
SPM C3    H31    sing N N 199 
SPM C3    H32    sing N N 200 
SPM C4    N5     sing N N 201 
SPM C4    H41    sing N N 202 
SPM C4    H42    sing N N 203 
SPM N5    C6     sing N N 204 
SPM N5    HN5    sing N N 205 
SPM C6    C7     sing N N 206 
SPM C6    H61    sing N N 207 
SPM C6    H62    sing N N 208 
SPM C7    C8     sing N N 209 
SPM C7    H71    sing N N 210 
SPM C7    H72    sing N N 211 
SPM C8    C9     sing N N 212 
SPM C8    H81    sing N N 213 
SPM C8    H82    sing N N 214 
SPM C9    N10    sing N N 215 
SPM C9    H91    sing N N 216 
SPM C9    H92    sing N N 217 
SPM N10   C11    sing N N 218 
SPM N10   HN0    sing N N 219 
SPM C11   C12    sing N N 220 
SPM C11   H111   sing N N 221 
SPM C11   H112   sing N N 222 
SPM C12   C13    sing N N 223 
SPM C12   H121   sing N N 224 
SPM C12   H122   sing N N 225 
SPM C13   N14    sing N N 226 
SPM C13   H131   sing N N 227 
SPM C13   H132   sing N N 228 
SPM N14   HN41   sing N N 229 
SPM N14   HN42   sing N N 230 
# 
_ndb_struct_conf_na.entry_id   9K8Z 
_ndb_struct_conf_na.feature    'a-form double helix' 
# 
loop_
_ndb_struct_na_base_pair.model_number 
_ndb_struct_na_base_pair.i_label_asym_id 
_ndb_struct_na_base_pair.i_label_comp_id 
_ndb_struct_na_base_pair.i_label_seq_id 
_ndb_struct_na_base_pair.i_symmetry 
_ndb_struct_na_base_pair.j_label_asym_id 
_ndb_struct_na_base_pair.j_label_comp_id 
_ndb_struct_na_base_pair.j_label_seq_id 
_ndb_struct_na_base_pair.j_symmetry 
_ndb_struct_na_base_pair.shear 
_ndb_struct_na_base_pair.stretch 
_ndb_struct_na_base_pair.stagger 
_ndb_struct_na_base_pair.buckle 
_ndb_struct_na_base_pair.propeller 
_ndb_struct_na_base_pair.opening 
_ndb_struct_na_base_pair.pair_number 
_ndb_struct_na_base_pair.pair_name 
_ndb_struct_na_base_pair.i_auth_asym_id 
_ndb_struct_na_base_pair.i_auth_seq_id 
_ndb_struct_na_base_pair.i_PDB_ins_code 
_ndb_struct_na_base_pair.j_auth_asym_id 
_ndb_struct_na_base_pair.j_auth_seq_id 
_ndb_struct_na_base_pair.j_PDB_ins_code 
_ndb_struct_na_base_pair.hbond_type_28 
_ndb_struct_na_base_pair.hbond_type_12 
1 A G 1 1_555 B 5CM 9 1_555 -0.323 -0.087 -0.089 -6.674  -12.638 0.242  1 A_G1:5CM9_B A 1 ? B 9 ? 19 1 
1 A A 2 1_555 B DT  8 1_555 0.076  -0.099 -0.035 -4.642  -17.122 3.083  2 A_A2:DT8_B  A 2 ? B 8 ? 20 1 
1 A A 3 1_555 B DT  7 1_555 -0.016 -0.109 0.003  -6.553  -20.524 7.880  3 A_A3:DT7_B  A 3 ? B 7 ? 20 1 
1 A G 4 1_555 B DC  6 1_555 -0.247 -0.177 -0.257 -13.269 -11.273 -1.941 4 A_G4:DC6_B  A 4 ? B 6 ? 19 1 
1 A A 5 1_555 B DT  5 1_555 0.182  -0.019 -0.364 -13.976 -7.224  -4.966 5 A_A5:DT5_B  A 5 ? B 5 ? 20 1 
1 A A 6 1_555 B DT  4 1_555 0.037  -0.256 0.085  -1.326  -6.967  2.319  6 A_A6:DT4_B  A 6 ? B 4 ? 20 1 
1 A G 7 1_555 B DC  3 1_555 -0.084 0.048  0.034  -2.287  -12.279 3.165  7 A_G7:DC3_B  A 7 ? B 3 ? 19 1 
1 A A 8 1_555 B DT  2 1_555 0.004  -0.151 -0.103 0.167   -3.721  -0.875 8 A_A8:DT2_B  A 8 ? B 2 ? 20 1 
1 A G 9 1_555 B 5CM 1 1_555 -0.166 -0.091 0.089  9.140   0.209   -0.668 9 A_G9:5CM1_B A 9 ? B 1 ? 19 1 
# 
loop_
_ndb_struct_na_base_pair_step.model_number 
_ndb_struct_na_base_pair_step.i_label_asym_id_1 
_ndb_struct_na_base_pair_step.i_label_comp_id_1 
_ndb_struct_na_base_pair_step.i_label_seq_id_1 
_ndb_struct_na_base_pair_step.i_symmetry_1 
_ndb_struct_na_base_pair_step.j_label_asym_id_1 
_ndb_struct_na_base_pair_step.j_label_comp_id_1 
_ndb_struct_na_base_pair_step.j_label_seq_id_1 
_ndb_struct_na_base_pair_step.j_symmetry_1 
_ndb_struct_na_base_pair_step.i_label_asym_id_2 
_ndb_struct_na_base_pair_step.i_label_comp_id_2 
_ndb_struct_na_base_pair_step.i_label_seq_id_2 
_ndb_struct_na_base_pair_step.i_symmetry_2 
_ndb_struct_na_base_pair_step.j_label_asym_id_2 
_ndb_struct_na_base_pair_step.j_label_comp_id_2 
_ndb_struct_na_base_pair_step.j_label_seq_id_2 
_ndb_struct_na_base_pair_step.j_symmetry_2 
_ndb_struct_na_base_pair_step.shift 
_ndb_struct_na_base_pair_step.slide 
_ndb_struct_na_base_pair_step.rise 
_ndb_struct_na_base_pair_step.tilt 
_ndb_struct_na_base_pair_step.roll 
_ndb_struct_na_base_pair_step.twist 
_ndb_struct_na_base_pair_step.x_displacement 
_ndb_struct_na_base_pair_step.y_displacement 
_ndb_struct_na_base_pair_step.helical_rise 
_ndb_struct_na_base_pair_step.inclination 
_ndb_struct_na_base_pair_step.tip 
_ndb_struct_na_base_pair_step.helical_twist 
_ndb_struct_na_base_pair_step.step_number 
_ndb_struct_na_base_pair_step.step_name 
_ndb_struct_na_base_pair_step.i_auth_asym_id_1 
_ndb_struct_na_base_pair_step.i_auth_seq_id_1 
_ndb_struct_na_base_pair_step.i_PDB_ins_code_1 
_ndb_struct_na_base_pair_step.j_auth_asym_id_1 
_ndb_struct_na_base_pair_step.j_auth_seq_id_1 
_ndb_struct_na_base_pair_step.j_PDB_ins_code_1 
_ndb_struct_na_base_pair_step.i_auth_asym_id_2 
_ndb_struct_na_base_pair_step.i_auth_seq_id_2 
_ndb_struct_na_base_pair_step.i_PDB_ins_code_2 
_ndb_struct_na_base_pair_step.j_auth_asym_id_2 
_ndb_struct_na_base_pair_step.j_auth_seq_id_2 
_ndb_struct_na_base_pair_step.j_PDB_ins_code_2 
1 A G 1 1_555 B 5CM 9 1_555 A A 2 1_555 B DT  8 1_555 0.462  -1.192 3.261 1.290  1.819  36.202 -2.166 -0.563 3.213 2.924  -2.073 
36.268 1 AA_G1A2:DT85CM9_BB A 1 ? B 9 ? A 2 ? B 8 ? 
1 A A 2 1_555 B DT  8 1_555 A A 3 1_555 B DT  7 1_555 0.394  -1.131 3.317 0.762  3.908  32.752 -2.653 -0.565 3.173 6.898  -1.345 
32.987 2 AA_A2A3:DT7DT8_BB  A 2 ? B 8 ? A 3 ? B 7 ? 
1 A A 3 1_555 B DT  7 1_555 A G 4 1_555 B DC  6 1_555 -1.321 -1.239 3.360 -2.897 12.448 35.699 -3.484 1.670  2.879 19.549 4.549  
37.847 3 AA_A3G4:DC6DT7_BB  A 3 ? B 7 ? A 4 ? B 6 ? 
1 A G 4 1_555 B DC  6 1_555 A A 5 1_555 B DT  5 1_555 0.834  -1.765 3.399 4.484  13.660 30.196 -5.222 -0.747 2.488 24.548 -8.058 
33.371 4 AA_G4A5:DT5DC6_BB  A 4 ? B 6 ? A 5 ? B 5 ? 
1 A A 5 1_555 B DT  5 1_555 A A 6 1_555 B DT  4 1_555 0.747  -1.642 3.069 -1.094 1.529  24.958 -4.207 -2.023 2.930 3.533  2.528  
25.027 5 AA_A5A6:DT4DT5_BB  A 5 ? B 5 ? A 6 ? B 4 ? 
1 A A 6 1_555 B DT  4 1_555 A G 7 1_555 B DC  3 1_555 0.290  -1.511 3.359 0.414  3.435  31.988 -3.343 -0.449 3.187 6.211  -0.748 
32.170 6 AA_A6G7:DC3DT4_BB  A 6 ? B 4 ? A 7 ? B 3 ? 
1 A G 7 1_555 B DC  3 1_555 A A 8 1_555 B DT  2 1_555 -1.095 -1.394 3.194 -0.126 8.748  35.174 -3.383 1.745  2.783 14.205 0.205  
36.212 7 AA_G7A8:DT2DC3_BB  A 7 ? B 3 ? A 8 ? B 2 ? 
1 A A 8 1_555 B DT  2 1_555 A G 9 1_555 B 5CM 1 1_555 0.683  -1.906 3.078 -0.445 0.665  26.958 -4.246 -1.571 3.020 1.426  0.953  
26.970 8 AA_A8G9:5CM1DT2_BB A 8 ? B 2 ? A 9 ? B 1 ? 
# 
_pdbx_audit_support.funding_organization   'Japan Agency for Medical Research and Development (AMED)' 
_pdbx_audit_support.country                Japan 
_pdbx_audit_support.grant_number           JP23ama121014 
_pdbx_audit_support.ordinal                1 
# 
_pdbx_initial_refinement_model.accession_code   4U6M 
_pdbx_initial_refinement_model.details          ? 
_pdbx_initial_refinement_model.entity_id_list   ? 
_pdbx_initial_refinement_model.id               1 
_pdbx_initial_refinement_model.source_name      PDB 
_pdbx_initial_refinement_model.type             'experimental model' 
# 
_atom_sites.entry_id                    9K8Z 
_atom_sites.Cartn_transf_matrix[1][1]   ? 
_atom_sites.Cartn_transf_matrix[1][2]   ? 
_atom_sites.Cartn_transf_matrix[1][3]   ? 
_atom_sites.Cartn_transf_matrix[2][1]   ? 
_atom_sites.Cartn_transf_matrix[2][2]   ? 
_atom_sites.Cartn_transf_matrix[2][3]   ? 
_atom_sites.Cartn_transf_matrix[3][1]   ? 
_atom_sites.Cartn_transf_matrix[3][2]   ? 
_atom_sites.Cartn_transf_matrix[3][3]   ? 
_atom_sites.Cartn_transf_vector[1]      ? 
_atom_sites.Cartn_transf_vector[2]      ? 
_atom_sites.Cartn_transf_vector[3]      ? 
_atom_sites.Cartn_transform_axes        ? 
_atom_sites.fract_transf_matrix[1][1]   0.020552 
_atom_sites.fract_transf_matrix[1][2]   0.011866 
_atom_sites.fract_transf_matrix[1][3]   0.000000 
_atom_sites.fract_transf_matrix[2][1]   0.000000 
_atom_sites.fract_transf_matrix[2][2]   0.023732 
_atom_sites.fract_transf_matrix[2][3]   0.000000 
_atom_sites.fract_transf_matrix[3][1]   0.000000 
_atom_sites.fract_transf_matrix[3][2]   0.000000 
_atom_sites.fract_transf_matrix[3][3]   0.021864 
_atom_sites.fract_transf_vector[1]      0.00000 
_atom_sites.fract_transf_vector[2]      0.00000 
_atom_sites.fract_transf_vector[3]      0.00000 
_atom_sites.solution_primary            ? 
_atom_sites.solution_secondary          ? 
_atom_sites.solution_hydrogens          ? 
_atom_sites.special_details             ? 
# 
loop_
_atom_type.symbol 
C 
N 
O 
P 
# 
loop_
_atom_site.group_PDB 
_atom_site.id 
_atom_site.type_symbol 
_atom_site.label_atom_id 
_atom_site.label_alt_id 
_atom_site.label_comp_id 
_atom_site.label_asym_id 
_atom_site.label_entity_id 
_atom_site.label_seq_id 
_atom_site.pdbx_PDB_ins_code 
_atom_site.Cartn_x 
_atom_site.Cartn_y 
_atom_site.Cartn_z 
_atom_site.occupancy 
_atom_site.B_iso_or_equiv 
_atom_site.pdbx_formal_charge 
_atom_site.auth_seq_id 
_atom_site.auth_comp_id 
_atom_site.auth_asym_id 
_atom_site.auth_atom_id 
_atom_site.pdbx_PDB_model_num 
ATOM   1   O "O5'" . G   A 1 1 ? -16.671 -7.545  4.485   1.00 28.61 ? 1   G   A "O5'" 1 
ATOM   2   C "C5'" . G   A 1 1 ? -17.959 -7.059  4.822   1.00 27.40 ? 1   G   A "C5'" 1 
ATOM   3   C "C4'" . G   A 1 1 ? -18.872 -7.073  3.626   1.00 25.85 ? 1   G   A "C4'" 1 
ATOM   4   O "O4'" . G   A 1 1 ? -18.361 -6.180  2.602   1.00 24.80 ? 1   G   A "O4'" 1 
ATOM   5   C "C3'" . G   A 1 1 ? -19.009 -8.403  2.908   1.00 24.91 ? 1   G   A "C3'" 1 
ATOM   6   O "O3'" . G   A 1 1 ? -19.903 -9.288  3.555   1.00 26.43 ? 1   G   A "O3'" 1 
ATOM   7   C "C2'" . G   A 1 1 ? -19.473 -7.979  1.520   1.00 22.95 ? 1   G   A "C2'" 1 
ATOM   8   O "O2'" . G   A 1 1 ? -20.858 -7.661  1.523   1.00 24.23 ? 1   G   A "O2'" 1 
ATOM   9   C "C1'" . G   A 1 1 ? -18.685 -6.685  1.323   1.00 23.74 ? 1   G   A "C1'" 1 
ATOM   10  N N9    . G   A 1 1 ? -17.440 -6.905  0.569   1.00 22.52 ? 1   G   A N9    1 
ATOM   11  C C8    . G   A 1 1 ? -16.152 -6.823  1.034   1.00 20.98 ? 1   G   A C8    1 
ATOM   12  N N7    . G   A 1 1 ? -15.255 -7.064  0.115   1.00 22.57 ? 1   G   A N7    1 
ATOM   13  C C5    . G   A 1 1 ? -16.003 -7.314  -1.034  1.00 20.60 ? 1   G   A C5    1 
ATOM   14  C C6    . G   A 1 1 ? -15.590 -7.637  -2.356  1.00 20.32 ? 1   G   A C6    1 
ATOM   15  O O6    . G   A 1 1 ? -14.445 -7.766  -2.807  1.00 19.90 ? 1   G   A O6    1 
ATOM   16  N N1    . G   A 1 1 ? -16.690 -7.809  -3.198  1.00 18.63 ? 1   G   A N1    1 
ATOM   17  C C2    . G   A 1 1 ? -18.009 -7.691  -2.828  1.00 17.77 ? 1   G   A C2    1 
ATOM   18  N N2    . G   A 1 1 ? -18.927 -7.894  -3.783  1.00 19.84 ? 1   G   A N2    1 
ATOM   19  N N3    . G   A 1 1 ? -18.407 -7.396  -1.602  1.00 20.22 ? 1   G   A N3    1 
ATOM   20  C C4    . G   A 1 1 ? -17.354 -7.218  -0.768  1.00 20.65 ? 1   G   A C4    1 
ATOM   21  P P     . A   A 1 2 ? -19.619 -10.866 3.569   1.00 26.29 ? 2   A   A P     1 
ATOM   22  O OP1   . A   A 1 2 ? -20.622 -11.484 4.478   1.00 30.32 ? 2   A   A OP1   1 
ATOM   23  O OP2   . A   A 1 2 ? -18.176 -11.103 3.787   1.00 25.98 ? 2   A   A OP2   1 
ATOM   24  O "O5'" . A   A 1 2 ? -19.954 -11.330 2.085   1.00 23.10 ? 2   A   A "O5'" 1 
ATOM   25  C "C5'" . A   A 1 2 ? -21.280 -11.250 1.599   1.00 22.24 ? 2   A   A "C5'" 1 
ATOM   26  C "C4'" . A   A 1 2 ? -21.312 -11.354 0.101   1.00 22.17 ? 2   A   A "C4'" 1 
ATOM   27  O "O4'" . A   A 1 2 ? -20.422 -10.365 -0.474  1.00 21.88 ? 2   A   A "O4'" 1 
ATOM   28  C "C3'" . A   A 1 2 ? -20.818 -12.660 -0.493  1.00 18.17 ? 2   A   A "C3'" 1 
ATOM   29  O "O3'" . A   A 1 2 ? -21.782 -13.690 -0.422  1.00 21.75 ? 2   A   A "O3'" 1 
ATOM   30  C "C2'" . A   A 1 2 ? -20.489 -12.245 -1.914  1.00 19.73 ? 2   A   A "C2'" 1 
ATOM   31  O "O2'" . A   A 1 2 ? -21.691 -12.056 -2.648  1.00 21.15 ? 2   A   A "O2'" 1 
ATOM   32  C "C1'" . A   A 1 2 ? -19.880 -10.865 -1.678  1.00 19.27 ? 2   A   A "C1'" 1 
ATOM   33  N N9    . A   A 1 2 ? -18.412 -10.899 -1.546  1.00 18.12 ? 2   A   A N9    1 
ATOM   34  C C8    . A   A 1 2 ? -17.652 -10.782 -0.409  1.00 20.11 ? 2   A   A C8    1 
ATOM   35  N N7    . A   A 1 2 ? -16.362 -10.824 -0.620  1.00 18.67 ? 2   A   A N7    1 
ATOM   36  C C5    . A   A 1 2 ? -16.260 -10.975 -2.000  1.00 17.67 ? 2   A   A C5    1 
ATOM   37  C C6    . A   A 1 2 ? -15.156 -11.084 -2.857  1.00 17.03 ? 2   A   A C6    1 
ATOM   38  N N6    . A   A 1 2 ? -13.891 -11.051 -2.445  1.00 18.51 ? 2   A   A N6    1 
ATOM   39  N N1    . A   A 1 2 ? -15.401 -11.223 -4.180  1.00 14.69 ? 2   A   A N1    1 
ATOM   40  C C2    . A   A 1 2 ? -16.667 -11.247 -4.591  1.00 16.90 ? 2   A   A C2    1 
ATOM   41  N N3    . A   A 1 2 ? -17.785 -11.150 -3.880  1.00 16.44 ? 2   A   A N3    1 
ATOM   42  C C4    . A   A 1 2 ? -17.510 -11.015 -2.575  1.00 18.58 ? 2   A   A C4    1 
ATOM   43  P P     . A   A 1 3 ? -21.327 -15.226 -0.324  1.00 21.45 ? 3   A   A P     1 
ATOM   44  O OP1   . A   A 1 3 ? -22.571 -16.015 -0.118  1.00 24.27 ? 3   A   A OP1   1 
ATOM   45  O OP2   . A   A 1 3 ? -20.174 -15.336 0.602   1.00 23.47 ? 3   A   A OP2   1 
ATOM   46  O "O5'" . A   A 1 3 ? -20.771 -15.566 -1.779  1.00 19.98 ? 3   A   A "O5'" 1 
ATOM   47  C "C5'" . A   A 1 3 ? -21.613 -15.527 -2.922  1.00 20.99 ? 3   A   A "C5'" 1 
ATOM   48  C "C4'" . A   A 1 3 ? -20.802 -15.543 -4.195  1.00 18.82 ? 3   A   A "C4'" 1 
ATOM   49  O "O4'" . A   A 1 3 ? -19.886 -14.421 -4.210  1.00 19.81 ? 3   A   A "O4'" 1 
ATOM   50  C "C3'" . A   A 1 3 ? -19.903 -16.751 -4.400  1.00 19.44 ? 3   A   A "C3'" 1 
ATOM   51  O "O3'" . A   A 1 3 ? -20.594 -17.871 -4.911  1.00 20.25 ? 3   A   A "O3'" 1 
ATOM   52  C "C2'" . A   A 1 3 ? -18.852 -16.223 -5.361  1.00 18.51 ? 3   A   A "C2'" 1 
ATOM   53  O "O2'" . A   A 1 3 ? -19.363 -16.188 -6.688  1.00 19.69 ? 3   A   A "O2'" 1 
ATOM   54  C "C1'" . A   A 1 3 ? -18.690 -14.789 -4.867  1.00 17.48 ? 3   A   A "C1'" 1 
ATOM   55  N N9    . A   A 1 3 ? -17.578 -14.661 -3.912  1.00 15.93 ? 3   A   A N9    1 
ATOM   56  C C8    . A   A 1 3 ? -17.618 -14.579 -2.545  1.00 17.98 ? 3   A   A C8    1 
ATOM   57  N N7    . A   A 1 3 ? -16.435 -14.476 -1.993  1.00 16.91 ? 3   A   A N7    1 
ATOM   58  C C5    . A   A 1 3 ? -15.549 -14.482 -3.068  1.00 16.87 ? 3   A   A C5    1 
ATOM   59  C C6    . A   A 1 3 ? -14.143 -14.390 -3.163  1.00 15.95 ? 3   A   A C6    1 
ATOM   60  N N6    . A   A 1 3 ? -13.301 -14.262 -2.124  1.00 16.73 ? 3   A   A N6    1 
ATOM   61  N N1    . A   A 1 3 ? -13.604 -14.436 -4.398  1.00 15.07 ? 3   A   A N1    1 
ATOM   62  C C2    . A   A 1 3 ? -14.407 -14.564 -5.458  1.00 16.70 ? 3   A   A C2    1 
ATOM   63  N N3    . A   A 1 3 ? -15.732 -14.652 -5.494  1.00 15.35 ? 3   A   A N3    1 
ATOM   64  C C4    . A   A 1 3 ? -16.249 -14.602 -4.253  1.00 15.96 ? 3   A   A C4    1 
ATOM   65  P P     . G   A 1 4 ? -19.934 -19.328 -4.814  1.00 22.47 ? 4   G   A P     1 
ATOM   66  O OP1   . G   A 1 4 ? -20.999 -20.307 -5.163  1.00 26.42 ? 4   G   A OP1   1 
ATOM   67  O OP2   . G   A 1 4 ? -19.236 -19.466 -3.511  1.00 22.84 ? 4   G   A OP2   1 
ATOM   68  O "O5'" . G   A 1 4 ? -18.791 -19.338 -5.928  1.00 21.51 ? 4   G   A "O5'" 1 
ATOM   69  C "C5'" . G   A 1 4 ? -19.072 -19.584 -7.298  1.00 24.57 ? 4   G   A "C5'" 1 
ATOM   70  C "C4'" . G   A 1 4 ? -17.803 -19.849 -8.074  1.00 22.99 ? 4   G   A "C4'" 1 
ATOM   71  O "O4'" . G   A 1 4 ? -16.951 -18.667 -8.048  1.00 19.46 ? 4   G   A "O4'" 1 
ATOM   72  C "C3'" . G   A 1 4 ? -16.906 -20.949 -7.530  1.00 21.74 ? 4   G   A "C3'" 1 
ATOM   73  O "O3'" . G   A 1 4 ? -17.334 -22.259 -7.862  1.00 26.27 ? 4   G   A "O3'" 1 
ATOM   74  C "C2'" . G   A 1 4 ? -15.552 -20.579 -8.112  1.00 21.05 ? 4   G   A "C2'" 1 
ATOM   75  O "O2'" . G   A 1 4 ? -15.506 -20.906 -9.495  1.00 23.13 ? 4   G   A "O2'" 1 
ATOM   76  C "C1'" . G   A 1 4 ? -15.594 -19.058 -7.977  1.00 19.84 ? 4   G   A "C1'" 1 
ATOM   77  N N9    . G   A 1 4 ? -15.076 -18.613 -6.669  1.00 16.98 ? 4   G   A N9    1 
ATOM   78  C C8    . G   A 1 4 ? -15.848 -18.313 -5.574  1.00 17.49 ? 4   G   A C8    1 
ATOM   79  N N7    . G   A 1 4 ? -15.149 -17.952 -4.539  1.00 16.99 ? 4   G   A N7    1 
ATOM   80  C C5    . G   A 1 4 ? -13.830 -18.022 -4.968  1.00 16.85 ? 4   G   A C5    1 
ATOM   81  C C6    . G   A 1 4 ? -12.627 -17.734 -4.269  1.00 15.39 ? 4   G   A C6    1 
ATOM   82  O O6    . G   A 1 4 ? -12.513 -17.355 -3.096  1.00 15.70 ? 4   G   A O6    1 
ATOM   83  N N1    . G   A 1 4 ? -11.495 -17.932 -5.055  1.00 14.34 ? 4   G   A N1    1 
ATOM   84  C C2    . G   A 1 4 ? -11.527 -18.348 -6.365  1.00 16.04 ? 4   G   A C2    1 
ATOM   85  N N2    . G   A 1 4 ? -10.325 -18.481 -6.962  1.00 17.03 ? 4   G   A N2    1 
ATOM   86  N N3    . G   A 1 4 ? -12.644 -18.610 -7.033  1.00 16.84 ? 4   G   A N3    1 
ATOM   87  C C4    . G   A 1 4 ? -13.760 -18.428 -6.281  1.00 16.06 ? 4   G   A C4    1 
ATOM   88  P P     . A   A 1 5 ? -17.114 -23.457 -6.811  1.00 29.67 ? 5   A   A P     1 
ATOM   89  O OP1   . A   A 1 5 ? -17.425 -24.711 -7.555  1.00 32.03 ? 5   A   A OP1   1 
ATOM   90  O OP2   . A   A 1 5 ? -17.832 -23.126 -5.555  1.00 30.54 ? 5   A   A OP2   1 
ATOM   91  O "O5'" . A   A 1 5 ? -15.553 -23.408 -6.462  1.00 29.55 ? 5   A   A "O5'" 1 
ATOM   92  C "C5'" . A   A 1 5 ? -14.632 -24.240 -7.149  1.00 29.83 ? 5   A   A "C5'" 1 
ATOM   93  C "C4'" . A   A 1 5 ? -13.186 -24.011 -6.757  1.00 26.83 ? 5   A   A "C4'" 1 
ATOM   94  O "O4'" . A   A 1 5 ? -12.872 -22.595 -6.610  1.00 23.09 ? 5   A   A "O4'" 1 
ATOM   95  C "C3'" . A   A 1 5 ? -12.675 -24.596 -5.451  1.00 27.51 ? 5   A   A "C3'" 1 
ATOM   96  O "O3'" . A   A 1 5 ? -12.564 -26.013 -5.423  1.00 28.80 ? 5   A   A "O3'" 1 
ATOM   97  C "C2'" . A   A 1 5 ? -11.341 -23.876 -5.322  1.00 22.06 ? 5   A   A "C2'" 1 
ATOM   98  O "O2'" . A   A 1 5 ? -10.413 -24.394 -6.265  1.00 23.68 ? 5   A   A "O2'" 1 
ATOM   99  C "C1'" . A   A 1 5 ? -11.740 -22.462 -5.762  1.00 22.81 ? 5   A   A "C1'" 1 
ATOM   100 N N9    . A   A 1 5 ? -12.096 -21.675 -4.571  1.00 19.67 ? 5   A   A N9    1 
ATOM   101 C C8    . A   A 1 5 ? -13.338 -21.420 -4.041  1.00 20.18 ? 5   A   A C8    1 
ATOM   102 N N7    . A   A 1 5 ? -13.287 -20.732 -2.922  1.00 18.89 ? 5   A   A N7    1 
ATOM   103 C C5    . A   A 1 5 ? -11.929 -20.553 -2.681  1.00 18.29 ? 5   A   A C5    1 
ATOM   104 C C6    . A   A 1 5 ? -11.225 -19.903 -1.645  1.00 18.98 ? 5   A   A C6    1 
ATOM   105 N N6    . A   A 1 5 ? -11.807 -19.295 -0.607  1.00 18.97 ? 5   A   A N6    1 
ATOM   106 N N1    . A   A 1 5 ? -9.876  -19.899 -1.706  1.00 17.60 ? 5   A   A N1    1 
ATOM   107 C C2    . A   A 1 5 ? -9.282  -20.515 -2.742  1.00 18.98 ? 5   A   A C2    1 
ATOM   108 N N3    . A   A 1 5 ? -9.837  -21.153 -3.768  1.00 18.75 ? 5   A   A N3    1 
ATOM   109 C C4    . A   A 1 5 ? -11.183 -21.140 -3.680  1.00 19.85 ? 5   A   A C4    1 
ATOM   110 P P     . A   A 1 6 ? -12.668 -26.804 -4.017  1.00 32.69 ? 6   A   A P     1 
ATOM   111 O OP1   . A   A 1 6 ? -12.789 -28.254 -4.314  1.00 37.29 ? 6   A   A OP1   1 
ATOM   112 O OP2   . A   A 1 6 ? -13.677 -26.136 -3.159  1.00 33.29 ? 6   A   A OP2   1 
ATOM   113 O "O5'" . A   A 1 6 ? -11.265 -26.564 -3.310  1.00 32.73 ? 6   A   A "O5'" 1 
ATOM   114 C "C5'" . A   A 1 6 ? -10.054 -26.911 -3.956  1.00 29.96 ? 6   A   A "C5'" 1 
ATOM   115 C "C4'" . A   A 1 6 ? -8.879  -26.212 -3.326  1.00 29.76 ? 6   A   A "C4'" 1 
ATOM   116 O "O4'" . A   A 1 6 ? -9.124  -24.784 -3.249  1.00 27.07 ? 6   A   A "O4'" 1 
ATOM   117 C "C3'" . A   A 1 6 ? -8.562  -26.597 -1.894  1.00 28.49 ? 6   A   A "C3'" 1 
ATOM   118 O "O3'" . A   A 1 6 ? -7.877  -27.833 -1.808  1.00 29.25 ? 6   A   A "O3'" 1 
ATOM   119 C "C2'" . A   A 1 6 ? -7.755  -25.398 -1.414  1.00 27.33 ? 6   A   A "C2'" 1 
ATOM   120 O "O2'" . A   A 1 6 ? -6.431  -25.437 -1.928  1.00 28.98 ? 6   A   A "O2'" 1 
ATOM   121 C "C1'" . A   A 1 6 ? -8.496  -24.252 -2.102  1.00 26.74 ? 6   A   A "C1'" 1 
ATOM   122 N N9    . A   A 1 6 ? -9.519  -23.666 -1.218  1.00 24.70 ? 6   A   A N9    1 
ATOM   123 C C8    . A   A 1 6 ? -10.886 -23.812 -1.227  1.00 23.21 ? 6   A   A C8    1 
ATOM   124 N N7    . A   A 1 6 ? -11.491 -23.146 -0.267  1.00 23.16 ? 6   A   A N7    1 
ATOM   125 C C5    . A   A 1 6 ? -10.456 -22.530 0.419   1.00 20.41 ? 6   A   A C5    1 
ATOM   126 C C6    . A   A 1 6 ? -10.423 -21.682 1.538   1.00 19.72 ? 6   A   A C6    1 
ATOM   127 N N6    . A   A 1 6 ? -11.503 -21.277 2.206   1.00 19.76 ? 6   A   A N6    1 
ATOM   128 N N1    . A   A 1 6 ? -9.211  -21.248 1.959   1.00 20.34 ? 6   A   A N1    1 
ATOM   129 C C2    . A   A 1 6 ? -8.118  -21.648 1.289   1.00 20.00 ? 6   A   A C2    1 
ATOM   130 N N3    . A   A 1 6 ? -8.020  -22.439 0.233   1.00 23.12 ? 6   A   A N3    1 
ATOM   131 C C4    . A   A 1 6 ? -9.238  -22.848 -0.157  1.00 19.73 ? 6   A   A C4    1 
ATOM   132 P P     . G   A 1 7 ? -8.070  -28.788 -0.529  1.00 35.55 ? 7   G   A P     1 
ATOM   133 O OP1   . G   A 1 7 ? -7.481  -30.112 -0.858  1.00 34.14 ? 7   G   A OP1   1 
ATOM   134 O OP2   . G   A 1 7 ? -9.481  -28.710 -0.078  1.00 32.78 ? 7   G   A OP2   1 
ATOM   135 O "O5'" . G   A 1 7 ? -7.128  -28.117 0.549   1.00 26.91 ? 7   G   A "O5'" 1 
ATOM   136 C "C5'" . G   A 1 7 ? -5.721  -28.090 0.369   1.00 28.62 ? 7   G   A "C5'" 1 
ATOM   137 C "C4'" . G   A 1 7 ? -5.098  -27.017 1.216   1.00 25.55 ? 7   G   A "C4'" 1 
ATOM   138 O "O4'" . G   A 1 7 ? -5.827  -25.783 1.010   1.00 30.42 ? 7   G   A "O4'" 1 
ATOM   139 C "C3'" . G   A 1 7 ? -5.165  -27.244 2.721   1.00 24.96 ? 7   G   A "C3'" 1 
ATOM   140 O "O3'" . G   A 1 7 ? -4.100  -28.043 3.195   1.00 24.37 ? 7   G   A "O3'" 1 
ATOM   141 C "C2'" . G   A 1 7 ? -5.135  -25.832 3.279   1.00 26.38 ? 7   G   A "C2'" 1 
ATOM   142 O "O2'" . G   A 1 7 ? -3.807  -25.328 3.284   1.00 29.20 ? 7   G   A "O2'" 1 
ATOM   143 C "C1'" . G   A 1 7 ? -5.934  -25.075 2.221   1.00 24.32 ? 7   G   A "C1'" 1 
ATOM   144 N N9    . G   A 1 7 ? -7.366  -24.946 2.571   1.00 23.35 ? 7   G   A N9    1 
ATOM   145 C C8    . G   A 1 7 ? -8.459  -25.531 1.977   1.00 25.69 ? 7   G   A C8    1 
ATOM   146 N N7    . G   A 1 7 ? -9.593  -25.178 2.535   1.00 25.42 ? 7   G   A N7    1 
ATOM   147 C C5    . G   A 1 7 ? -9.218  -24.300 3.545   1.00 20.35 ? 7   G   A C5    1 
ATOM   148 C C6    . G   A 1 7 ? -9.990  -23.584 4.506   1.00 23.88 ? 7   G   A C6    1 
ATOM   149 O O6    . G   A 1 7 ? -11.214 -23.560 4.661   1.00 24.57 ? 7   G   A O6    1 
ATOM   150 N N1    . G   A 1 7 ? -9.194  -22.813 5.339   1.00 19.56 ? 7   G   A N1    1 
ATOM   151 C C2    . G   A 1 7 ? -7.824  -22.748 5.283   1.00 23.19 ? 7   G   A C2    1 
ATOM   152 N N2    . G   A 1 7 ? -7.211  -21.958 6.173   1.00 21.62 ? 7   G   A N2    1 
ATOM   153 N N3    . G   A 1 7 ? -7.094  -23.410 4.401   1.00 20.56 ? 7   G   A N3    1 
ATOM   154 C C4    . G   A 1 7 ? -7.850  -24.154 3.577   1.00 24.15 ? 7   G   A C4    1 
ATOM   155 P P     . A   A 1 8 ? -4.328  -29.084 4.395   1.00 20.92 ? 8   A   A P     1 
ATOM   156 O OP1   . A   A 1 8 ? -3.154  -30.002 4.355   1.00 24.08 ? 8   A   A OP1   1 
ATOM   157 O OP2   . A   A 1 8 ? -5.681  -29.657 4.318   1.00 21.26 ? 8   A   A OP2   1 
ATOM   158 O "O5'" . A   A 1 8 ? -4.260  -28.204 5.713   1.00 19.66 ? 8   A   A "O5'" 1 
ATOM   159 C "C5'" . A   A 1 8 ? -3.018  -27.904 6.312   1.00 20.99 ? 8   A   A "C5'" 1 
ATOM   160 C "C4'" . A   A 1 8 ? -3.205  -27.145 7.595   1.00 19.36 ? 8   A   A "C4'" 1 
ATOM   161 O "O4'" . A   A 1 8 ? -3.827  -25.857 7.329   1.00 18.50 ? 8   A   A "O4'" 1 
ATOM   162 C "C3'" . A   A 1 8 ? -4.127  -27.769 8.627   1.00 18.56 ? 8   A   A "C3'" 1 
ATOM   163 O "O3'" . A   A 1 8 ? -3.542  -28.846 9.333   1.00 18.88 ? 8   A   A "O3'" 1 
ATOM   164 C "C2'" . A   A 1 8 ? -4.463  -26.567 9.488   1.00 18.59 ? 8   A   A "C2'" 1 
ATOM   165 O "O2'" . A   A 1 8 ? -3.332  -26.190 10.261  1.00 19.73 ? 8   A   A "O2'" 1 
ATOM   166 C "C1'" . A   A 1 8 ? -4.678  -25.513 8.406   1.00 18.54 ? 8   A   A "C1'" 1 
ATOM   167 N N9    . A   A 1 8 ? -6.077  -25.548 7.932   1.00 17.74 ? 8   A   A N9    1 
ATOM   168 C C8    . A   A 1 8 ? -6.578  -26.242 6.860   1.00 18.36 ? 8   A   A C8    1 
ATOM   169 N N7    . A   A 1 8 ? -7.871  -26.123 6.685   1.00 18.67 ? 8   A   A N7    1 
ATOM   170 C C5    . A   A 1 8 ? -8.264  -25.304 7.735   1.00 15.52 ? 8   A   A C5    1 
ATOM   171 C C6    . A   A 1 8 ? -9.530  -24.808 8.112   1.00 16.55 ? 8   A   A C6    1 
ATOM   172 N N6    . A   A 1 8 ? -10.668 -25.071 7.464   1.00 16.75 ? 8   A   A N6    1 
ATOM   173 N N1    . A   A 1 8 ? -9.580  -24.041 9.219   1.00 16.54 ? 8   A   A N1    1 
ATOM   174 C C2    . A   A 1 8 ? -8.452  -23.767 9.874   1.00 16.53 ? 8   A   A C2    1 
ATOM   175 N N3    . A   A 1 8 ? -7.208  -24.173 9.619   1.00 17.43 ? 8   A   A N3    1 
ATOM   176 C C4    . A   A 1 8 ? -7.179  -24.952 8.519   1.00 16.42 ? 8   A   A C4    1 
ATOM   177 P P     . G   A 1 9 ? -4.460  -30.050 9.889   1.00 17.75 ? 9   G   A P     1 
ATOM   178 O OP1   . G   A 1 9 ? -3.540  -31.089 10.425  1.00 20.53 ? 9   G   A OP1   1 
ATOM   179 O OP2   . G   A 1 9 ? -5.459  -30.457 8.889   1.00 19.15 ? 9   G   A OP2   1 
ATOM   180 O "O5'" . G   A 1 9 ? -5.275  -29.391 11.093  1.00 18.16 ? 9   G   A "O5'" 1 
ATOM   181 C "C5'" . G   A 1 9 ? -4.615  -28.939 12.267  1.00 19.33 ? 9   G   A "C5'" 1 
ATOM   182 C "C4'" . G   A 1 9 ? -5.506  -28.048 13.104  1.00 19.06 ? 9   G   A "C4'" 1 
ATOM   183 O "O4'" . G   A 1 9 ? -6.037  -26.972 12.283  1.00 17.95 ? 9   G   A "O4'" 1 
ATOM   184 C "C3'" . G   A 1 9 ? -6.748  -28.691 13.695  1.00 17.73 ? 9   G   A "C3'" 1 
ATOM   185 O "O3'" . G   A 1 9 ? -6.484  -29.468 14.851  1.00 18.57 ? 9   G   A "O3'" 1 
ATOM   186 C "C2'" . G   A 1 9 ? -7.644  -27.484 13.950  1.00 18.28 ? 9   G   A "C2'" 1 
ATOM   187 O "O2'" . G   A 1 9 ? -7.241  -26.772 15.111  1.00 19.34 ? 9   G   A "O2'" 1 
ATOM   188 C "C1'" . G   A 1 9 ? -7.342  -26.634 12.717  1.00 17.05 ? 9   G   A "C1'" 1 
ATOM   189 N N9    . G   A 1 9 ? -8.306  -26.975 11.661  1.00 15.99 ? 9   G   A N9    1 
ATOM   190 C C8    . G   A 1 9 ? -8.137  -27.777 10.560  1.00 16.70 ? 9   G   A C8    1 
ATOM   191 N N7    . G   A 1 9 ? -9.225  -27.920 9.853   1.00 16.27 ? 9   G   A N7    1 
ATOM   192 C C5    . G   A 1 9 ? -10.177 -27.180 10.547  1.00 15.50 ? 9   G   A C5    1 
ATOM   193 C C6    . G   A 1 9 ? -11.547 -26.947 10.275  1.00 15.35 ? 9   G   A C6    1 
ATOM   194 O O6    . G   A 1 9 ? -12.223 -27.387 9.341   1.00 16.95 ? 9   G   A O6    1 
ATOM   195 N N1    . G   A 1 9 ? -12.144 -26.144 11.251  1.00 14.53 ? 9   G   A N1    1 
ATOM   196 C C2    . G   A 1 9 ? -11.498 -25.606 12.340  1.00 16.58 ? 9   G   A C2    1 
ATOM   197 N N2    . G   A 1 9 ? -12.229 -24.847 13.174  1.00 17.25 ? 9   G   A N2    1 
ATOM   198 N N3    . G   A 1 9 ? -10.216 -25.808 12.602  1.00 16.58 ? 9   G   A N3    1 
ATOM   199 C C4    . G   A 1 9 ? -9.625  -26.602 11.670  1.00 16.13 ? 9   G   A C4    1 
HETATM 200 N N1    . 5CM B 2 1 ? -17.065 -24.983 11.979  1.00 18.52 ? 1   5CM B N1    1 
HETATM 201 C C2    . 5CM B 2 1 ? -15.652 -25.092 12.026  1.00 18.07 ? 1   5CM B C2    1 
HETATM 202 N N3    . 5CM B 2 1 ? -15.004 -25.791 11.010  1.00 17.24 ? 1   5CM B N3    1 
HETATM 203 C C4    . 5CM B 2 1 ? -15.774 -26.318 10.061  1.00 18.31 ? 1   5CM B C4    1 
HETATM 204 C C5    . 5CM B 2 1 ? -17.174 -26.238 9.965   1.00 19.79 ? 1   5CM B C5    1 
HETATM 205 C C5A   . 5CM B 2 1 ? -17.893 -26.877 8.843   1.00 23.68 ? 1   5CM B C5A   1 
HETATM 206 C C6    . 5CM B 2 1 ? -17.824 -25.551 10.966  1.00 19.21 ? 1   5CM B C6    1 
HETATM 207 O O2    . 5CM B 2 1 ? -15.003 -24.583 12.939  1.00 17.76 ? 1   5CM B O2    1 
HETATM 208 N N4    . 5CM B 2 1 ? -15.056 -27.009 9.072   1.00 20.40 ? 1   5CM B N4    1 
HETATM 209 C "C1'" . 5CM B 2 1 ? -17.772 -24.239 13.081  1.00 19.64 ? 1   5CM B "C1'" 1 
HETATM 210 C "C2'" . 5CM B 2 1 ? -17.462 -22.741 12.921  1.00 19.29 ? 1   5CM B "C2'" 1 
HETATM 211 C "C3'" . 5CM B 2 1 ? -18.691 -22.237 12.198  1.00 20.34 ? 1   5CM B "C3'" 1 
HETATM 212 C "C4'" . 5CM B 2 1 ? -19.786 -23.201 12.724  1.00 20.12 ? 1   5CM B "C4'" 1 
HETATM 213 O "O4'" . 5CM B 2 1 ? -19.146 -24.443 12.969  1.00 21.26 ? 1   5CM B "O4'" 1 
HETATM 214 O "O3'" . 5CM B 2 1 ? -18.893 -20.913 12.544  1.00 21.44 ? 1   5CM B "O3'" 1 
HETATM 215 C "C5'" . 5CM B 2 1 ? -20.829 -23.394 11.596  1.00 23.86 ? 1   5CM B "C5'" 1 
HETATM 216 O "O5'" . 5CM B 2 1 ? -21.770 -24.216 12.145  1.00 29.10 ? 1   5CM B "O5'" 1 
ATOM   217 P P     . DT  B 2 2 ? -18.160 -19.726 11.742  1.00 21.23 ? 2   DT  B P     1 
ATOM   218 O OP1   . DT  B 2 2 ? -18.805 -18.475 12.224  1.00 24.62 ? 2   DT  B OP1   1 
ATOM   219 O OP2   . DT  B 2 2 ? -18.153 -20.047 10.293  1.00 22.20 ? 2   DT  B OP2   1 
ATOM   220 O "O5'" . DT  B 2 2 ? -16.639 -19.768 12.229  1.00 20.19 ? 2   DT  B "O5'" 1 
ATOM   221 C "C5'" . DT  B 2 2 ? -16.290 -19.403 13.556  1.00 19.86 ? 2   DT  B "C5'" 1 
ATOM   222 C "C4'" . DT  B 2 2 ? -14.795 -19.554 13.768  1.00 18.06 ? 2   DT  B "C4'" 1 
ATOM   223 O "O4'" . DT  B 2 2 ? -14.420 -20.950 13.643  1.00 19.18 ? 2   DT  B "O4'" 1 
ATOM   224 C "C3'" . DT  B 2 2 ? -13.925 -18.867 12.727  1.00 20.29 ? 2   DT  B "C3'" 1 
ATOM   225 O "O3'" . DT  B 2 2 ? -13.795 -17.495 13.011  1.00 22.67 ? 2   DT  B "O3'" 1 
ATOM   226 C "C2'" . DT  B 2 2 ? -12.612 -19.595 12.923  1.00 20.24 ? 2   DT  B "C2'" 1 
ATOM   227 C "C1'" . DT  B 2 2 ? -13.103 -21.023 13.097  1.00 18.47 ? 2   DT  B "C1'" 1 
ATOM   228 N N1    . DT  B 2 2 ? -13.126 -21.808 11.824  1.00 17.75 ? 2   DT  B N1    1 
ATOM   229 C C2    . DT  B 2 2 ? -11.945 -22.339 11.375  1.00 16.65 ? 2   DT  B C2    1 
ATOM   230 O O2    . DT  B 2 2 ? -10.890 -22.192 11.964  1.00 17.58 ? 2   DT  B O2    1 
ATOM   231 N N3    . DT  B 2 2 ? -12.037 -23.048 10.213  1.00 17.21 ? 2   DT  B N3    1 
ATOM   232 C C4    . DT  B 2 2 ? -13.169 -23.276 9.465   1.00 16.80 ? 2   DT  B C4    1 
ATOM   233 O O4    . DT  B 2 2 ? -13.146 -23.959 8.443   1.00 17.13 ? 2   DT  B O4    1 
ATOM   234 C C5    . DT  B 2 2 ? -14.387 -22.684 9.984   1.00 16.57 ? 2   DT  B C5    1 
ATOM   235 C C7    . DT  B 2 2 ? -15.687 -22.856 9.252   1.00 18.42 ? 2   DT  B C7    1 
ATOM   236 C C6    . DT  B 2 2 ? -14.305 -21.983 11.129  1.00 19.14 ? 2   DT  B C6    1 
ATOM   237 P P     . DC  B 2 3 ? -13.684 -16.441 11.797  1.00 22.88 ? 3   DC  B P     1 
ATOM   238 O OP1   . DC  B 2 3 ? -13.829 -15.086 12.385  1.00 29.39 ? 3   DC  B OP1   1 
ATOM   239 O OP2   . DC  B 2 3 ? -14.614 -16.888 10.748  1.00 24.16 ? 3   DC  B OP2   1 
ATOM   240 O "O5'" . DC  B 2 3 ? -12.188 -16.619 11.259  1.00 25.06 ? 3   DC  B "O5'" 1 
ATOM   241 C "C5'" . DC  B 2 3 ? -11.081 -16.379 12.120  1.00 25.23 ? 3   DC  B "C5'" 1 
ATOM   242 C "C4'" . DC  B 2 3 ? -9.835  -17.084 11.610  1.00 27.00 ? 3   DC  B "C4'" 1 
ATOM   243 O "O4'" . DC  B 2 3 ? -10.100 -18.499 11.453  1.00 26.91 ? 3   DC  B "O4'" 1 
ATOM   244 C "C3'" . DC  B 2 3 ? -9.359  -16.649 10.235  1.00 26.18 ? 3   DC  B "C3'" 1 
ATOM   245 O "O3'" . DC  B 2 3 ? -8.593  -15.452 10.337  1.00 28.40 ? 3   DC  B "O3'" 1 
ATOM   246 C "C2'" . DC  B 2 3 ? -8.496  -17.841 9.830   1.00 26.95 ? 3   DC  B "C2'" 1 
ATOM   247 C "C1'" . DC  B 2 3 ? -9.297  -19.019 10.396  1.00 23.89 ? 3   DC  B "C1'" 1 
ATOM   248 N N1    . DC  B 2 3 ? -10.179 -19.670 9.379   1.00 22.28 ? 3   DC  B N1    1 
ATOM   249 C C2    . DC  B 2 3 ? -9.621  -20.526 8.417   1.00 21.15 ? 3   DC  B C2    1 
ATOM   250 O O2    . DC  B 2 3 ? -8.401  -20.736 8.428   1.00 25.88 ? 3   DC  B O2    1 
ATOM   251 N N3    . DC  B 2 3 ? -10.428 -21.096 7.497   1.00 21.68 ? 3   DC  B N3    1 
ATOM   252 C C4    . DC  B 2 3 ? -11.737 -20.840 7.504   1.00 20.31 ? 3   DC  B C4    1 
ATOM   253 N N4    . DC  B 2 3 ? -12.488 -21.433 6.579   1.00 21.56 ? 3   DC  B N4    1 
ATOM   254 C C5    . DC  B 2 3 ? -12.330 -19.974 8.473   1.00 22.42 ? 3   DC  B C5    1 
ATOM   255 C C6    . DC  B 2 3 ? -11.523 -19.412 9.378   1.00 22.36 ? 3   DC  B C6    1 
ATOM   256 P P     . DT  B 2 4 ? -8.344  -14.529 9.039   1.00 26.77 ? 4   DT  B P     1 
ATOM   257 O OP1   . DT  B 2 4 ? -7.548  -13.371 9.499   1.00 29.70 ? 4   DT  B OP1   1 
ATOM   258 O OP2   . DT  B 2 4 ? -9.637  -14.304 8.353   1.00 28.13 ? 4   DT  B OP2   1 
ATOM   259 O "O5'" . DT  B 2 4 ? -7.439  -15.435 8.082   1.00 25.80 ? 4   DT  B "O5'" 1 
ATOM   260 C "C5'" . DT  B 2 4 ? -6.072  -15.662 8.389   1.00 22.41 ? 4   DT  B "C5'" 1 
ATOM   261 C "C4'" . DT  B 2 4 ? -5.388  -16.421 7.263   1.00 23.24 ? 4   DT  B "C4'" 1 
ATOM   262 O "O4'" . DT  B 2 4 ? -5.930  -17.763 7.166   1.00 23.10 ? 4   DT  B "O4'" 1 
ATOM   263 C "C3'" . DT  B 2 4 ? -5.608  -15.847 5.881   1.00 23.05 ? 4   DT  B "C3'" 1 
ATOM   264 O "O3'" . DT  B 2 4 ? -4.725  -14.780 5.650   1.00 21.78 ? 4   DT  B "O3'" 1 
ATOM   265 C "C2'" . DT  B 2 4 ? -5.274  -17.046 5.012   1.00 20.38 ? 4   DT  B "C2'" 1 
ATOM   266 C "C1'" . DT  B 2 4 ? -5.919  -18.176 5.807   1.00 22.70 ? 4   DT  B "C1'" 1 
ATOM   267 N N1    . DT  B 2 4 ? -7.321  -18.475 5.375   1.00 22.04 ? 4   DT  B N1    1 
ATOM   268 C C2    . DT  B 2 4 ? -7.520  -19.343 4.330   1.00 20.51 ? 4   DT  B C2    1 
ATOM   269 O O2    . DT  B 2 4 ? -6.606  -19.877 3.720   1.00 23.34 ? 4   DT  B O2    1 
ATOM   270 N N3    . DT  B 2 4 ? -8.830  -19.555 4.002   1.00 22.04 ? 4   DT  B N3    1 
ATOM   271 C C4    . DT  B 2 4 ? -9.940  -19.001 4.608   1.00 21.71 ? 4   DT  B C4    1 
ATOM   272 O O4    . DT  B 2 4 ? -11.080 -19.263 4.243   1.00 23.76 ? 4   DT  B O4    1 
ATOM   273 C C5    . DT  B 2 4 ? -9.664  -18.093 5.697   1.00 21.48 ? 4   DT  B C5    1 
ATOM   274 C C7    . DT  B 2 4 ? -10.792 -17.427 6.430   1.00 25.05 ? 4   DT  B C7    1 
ATOM   275 C C6    . DT  B 2 4 ? -8.381  -17.878 6.028   1.00 22.60 ? 4   DT  B C6    1 
ATOM   276 P P     . DT  B 2 5 ? -5.053  -13.710 4.501   1.00 20.76 ? 5   DT  B P     1 
ATOM   277 O OP1   . DT  B 2 5 ? -4.065  -12.621 4.656   1.00 22.68 ? 5   DT  B OP1   1 
ATOM   278 O OP2   . DT  B 2 5 ? -6.495  -13.410 4.551   1.00 19.90 ? 5   DT  B OP2   1 
ATOM   279 O "O5'" . DT  B 2 5 ? -4.756  -14.500 3.153   1.00 19.22 ? 5   DT  B "O5'" 1 
ATOM   280 C "C5'" . DT  B 2 5 ? -3.418  -14.807 2.809   1.00 19.75 ? 5   DT  B "C5'" 1 
ATOM   281 C "C4'" . DT  B 2 5 ? -3.370  -15.785 1.658   1.00 18.44 ? 5   DT  B "C4'" 1 
ATOM   282 O "O4'" . DT  B 2 5 ? -4.151  -16.964 1.983   1.00 19.25 ? 5   DT  B "O4'" 1 
ATOM   283 C "C3'" . DT  B 2 5 ? -3.983  -15.295 0.368   1.00 18.57 ? 5   DT  B "C3'" 1 
ATOM   284 O "O3'" . DT  B 2 5 ? -3.075  -14.461 -0.336  1.00 18.99 ? 5   DT  B "O3'" 1 
ATOM   285 C "C2'" . DT  B 2 5 ? -4.200  -16.610 -0.358  1.00 17.74 ? 5   DT  B "C2'" 1 
ATOM   286 C "C1'" . DT  B 2 5 ? -4.688  -17.498 0.782   1.00 18.13 ? 5   DT  B "C1'" 1 
ATOM   287 N N1    . DT  B 2 5 ? -6.180  -17.558 0.884   1.00 17.12 ? 5   DT  B N1    1 
ATOM   288 C C2    . DT  B 2 5 ? -6.848  -18.461 0.098   1.00 18.24 ? 5   DT  B C2    1 
ATOM   289 O O2    . DT  B 2 5 ? -6.283  -19.206 -0.681  1.00 19.31 ? 5   DT  B O2    1 
ATOM   290 N N3    . DT  B 2 5 ? -8.209  -18.465 0.248   1.00 17.67 ? 5   DT  B N3    1 
ATOM   291 C C4    . DT  B 2 5 ? -8.950  -17.669 1.088   1.00 18.03 ? 5   DT  B C4    1 
ATOM   292 O O4    . DT  B 2 5 ? -10.173 -17.758 1.160   1.00 18.37 ? 5   DT  B O4    1 
ATOM   293 C C5    . DT  B 2 5 ? -8.191  -16.734 1.889   1.00 17.17 ? 5   DT  B C5    1 
ATOM   294 C C7    . DT  B 2 5 ? -8.898  -15.817 2.841   1.00 19.35 ? 5   DT  B C7    1 
ATOM   295 C C6    . DT  B 2 5 ? -6.854  -16.720 1.750   1.00 18.07 ? 5   DT  B C6    1 
ATOM   296 P P     . DC  B 2 6 ? -3.621  -13.418 -1.427  1.00 18.87 ? 6   DC  B P     1 
ATOM   297 O OP1   . DC  B 2 6 ? -2.493  -12.516 -1.749  1.00 21.31 ? 6   DC  B OP1   1 
ATOM   298 O OP2   . DC  B 2 6 ? -4.904  -12.849 -0.938  1.00 20.90 ? 6   DC  B OP2   1 
ATOM   299 O "O5'" . DC  B 2 6 ? -3.981  -14.309 -2.701  1.00 19.58 ? 6   DC  B "O5'" 1 
ATOM   300 C "C5'" . DC  B 2 6 ? -2.952  -14.873 -3.502  1.00 18.40 ? 6   DC  B "C5'" 1 
ATOM   301 C "C4'" . DC  B 2 6 ? -3.545  -15.711 -4.620  1.00 17.54 ? 6   DC  B "C4'" 1 
ATOM   302 O "O4'" . DC  B 2 6 ? -4.338  -16.783 -4.049  1.00 17.70 ? 6   DC  B "O4'" 1 
ATOM   303 C "C3'" . DC  B 2 6 ? -4.516  -14.971 -5.520  1.00 18.48 ? 6   DC  B "C3'" 1 
ATOM   304 O "O3'" . DC  B 2 6 ? -3.815  -14.271 -6.531  1.00 18.62 ? 6   DC  B "O3'" 1 
ATOM   305 C "C2'" . DC  B 2 6 ? -5.335  -16.117 -6.101  1.00 17.48 ? 6   DC  B "C2'" 1 
ATOM   306 C "C1'" . DC  B 2 6 ? -5.465  -17.034 -4.884  1.00 16.76 ? 6   DC  B "C1'" 1 
ATOM   307 N N1    . DC  B 2 6 ? -6.715  -16.810 -4.090  1.00 16.41 ? 6   DC  B N1    1 
ATOM   308 C C2    . DC  B 2 6 ? -7.912  -17.376 -4.535  1.00 16.55 ? 6   DC  B C2    1 
ATOM   309 O O2    . DC  B 2 6 ? -7.909  -18.045 -5.578  1.00 17.25 ? 6   DC  B O2    1 
ATOM   310 N N3    . DC  B 2 6 ? -9.042  -17.188 -3.804  1.00 15.59 ? 6   DC  B N3    1 
ATOM   311 C C4    . DC  B 2 6 ? -9.010  -16.460 -2.684  1.00 15.69 ? 6   DC  B C4    1 
ATOM   312 N N4    . DC  B 2 6 ? -10.154 -16.308 -2.003  1.00 16.57 ? 6   DC  B N4    1 
ATOM   313 C C5    . DC  B 2 6 ? -7.799  -15.868 -2.211  1.00 16.71 ? 6   DC  B C5    1 
ATOM   314 C C6    . DC  B 2 6 ? -6.686  -16.062 -2.946  1.00 16.09 ? 6   DC  B C6    1 
ATOM   315 P P     . DT  B 2 7 ? -4.292  -12.805 -6.988  1.00 20.26 ? 7   DT  B P     1 
ATOM   316 O OP1   . DT  B 2 7 ? -3.330  -12.332 -8.014  1.00 22.41 ? 7   DT  B OP1   1 
ATOM   317 O OP2   . DT  B 2 7 ? -4.545  -11.992 -5.792  1.00 22.01 ? 7   DT  B OP2   1 
ATOM   318 O "O5'" . DT  B 2 7 ? -5.687  -13.058 -7.713  1.00 18.87 ? 7   DT  B "O5'" 1 
ATOM   319 C "C5'" . DT  B 2 7 ? -5.714  -13.685 -8.994  1.00 19.99 ? 7   DT  B "C5'" 1 
ATOM   320 C "C4'" . DT  B 2 7 ? -7.117  -14.139 -9.335  1.00 17.17 ? 7   DT  B "C4'" 1 
ATOM   321 O "O4'" . DT  B 2 7 ? -7.619  -14.970 -8.268  1.00 18.05 ? 7   DT  B "O4'" 1 
ATOM   322 C "C3'" . DT  B 2 7 ? -8.151  -13.030 -9.470  1.00 17.84 ? 7   DT  B "C3'" 1 
ATOM   323 O "O3'" . DT  B 2 7 ? -8.094  -12.473 -10.781 1.00 18.44 ? 7   DT  B "O3'" 1 
ATOM   324 C "C2'" . DT  B 2 7 ? -9.444  -13.809 -9.259  1.00 18.09 ? 7   DT  B "C2'" 1 
ATOM   325 C "C1'" . DT  B 2 7 ? -9.027  -14.816 -8.183  1.00 16.84 ? 7   DT  B "C1'" 1 
ATOM   326 N N1    . DT  B 2 7 ? -9.394  -14.387 -6.810  1.00 17.71 ? 7   DT  B N1    1 
ATOM   327 C C2    . DT  B 2 7 ? -10.671 -14.623 -6.382  1.00 16.22 ? 7   DT  B C2    1 
ATOM   328 O O2    . DT  B 2 7 ? -11.513 -15.146 -7.083  1.00 16.50 ? 7   DT  B O2    1 
ATOM   329 N N3    . DT  B 2 7 ? -10.939 -14.210 -5.107  1.00 16.07 ? 7   DT  B N3    1 
ATOM   330 C C4    . DT  B 2 7 ? -10.072 -13.590 -4.229  1.00 15.39 ? 7   DT  B C4    1 
ATOM   331 O O4    . DT  B 2 7 ? -10.417 -13.250 -3.097  1.00 15.68 ? 7   DT  B O4    1 
ATOM   332 C C5    . DT  B 2 7 ? -8.737  -13.364 -4.737  1.00 15.78 ? 7   DT  B C5    1 
ATOM   333 C C7    . DT  B 2 7 ? -7.704  -12.700 -3.868  1.00 18.61 ? 7   DT  B C7    1 
ATOM   334 C C6    . DT  B 2 7 ? -8.459  -13.776 -5.990  1.00 17.70 ? 7   DT  B C6    1 
ATOM   335 P P     . DT  B 2 8 ? -8.549  -10.953 -11.059 1.00 19.77 ? 8   DT  B P     1 
ATOM   336 O OP1   . DT  B 2 8 ? -8.059  -10.660 -12.421 1.00 22.51 ? 8   DT  B OP1   1 
ATOM   337 O OP2   . DT  B 2 8 ? -8.147  -10.082 -9.939  1.00 20.89 ? 8   DT  B OP2   1 
ATOM   338 O "O5'" . DT  B 2 8 ? -10.145 -11.006 -11.103 1.00 17.91 ? 8   DT  B "O5'" 1 
ATOM   339 C "C5'" . DT  B 2 8 ? -10.817 -11.701 -12.151 1.00 17.90 ? 8   DT  B "C5'" 1 
ATOM   340 C "C4'" . DT  B 2 8 ? -12.264 -11.963 -11.768 1.00 15.56 ? 8   DT  B "C4'" 1 
ATOM   341 O "O4'" . DT  B 2 8 ? -12.303 -12.709 -10.535 1.00 16.45 ? 8   DT  B "O4'" 1 
ATOM   342 C "C3'" . DT  B 2 8 ? -13.103 -10.726 -11.496 1.00 16.94 ? 8   DT  B "C3'" 1 
ATOM   343 O "O3'" . DT  B 2 8 ? -13.635 -10.252 -12.717 1.00 17.11 ? 8   DT  B "O3'" 1 
ATOM   344 C "C2'" . DT  B 2 8 ? -14.197 -11.293 -10.613 1.00 16.08 ? 8   DT  B "C2'" 1 
ATOM   345 C "C1'" . DT  B 2 8 ? -13.434 -12.314 -9.791  1.00 14.96 ? 8   DT  B "C1'" 1 
ATOM   346 N N1    . DT  B 2 8 ? -13.006 -11.823 -8.452  1.00 14.28 ? 8   DT  B N1    1 
ATOM   347 C C2    . DT  B 2 8 ? -13.927 -11.850 -7.452  1.00 15.35 ? 8   DT  B C2    1 
ATOM   348 O O2    . DT  B 2 8 ? -15.073 -12.209 -7.627  1.00 15.96 ? 8   DT  B O2    1 
ATOM   349 N N3    . DT  B 2 8 ? -13.472 -11.438 -6.237  1.00 15.47 ? 8   DT  B N3    1 
ATOM   350 C C4    . DT  B 2 8 ? -12.203 -11.004 -5.928  1.00 16.62 ? 8   DT  B C4    1 
ATOM   351 O O4    . DT  B 2 8 ? -11.890 -10.660 -4.792  1.00 16.04 ? 8   DT  B O4    1 
ATOM   352 C C5    . DT  B 2 8 ? -11.267 -10.994 -7.023  1.00 15.66 ? 8   DT  B C5    1 
ATOM   353 C C7    . DT  B 2 8 ? -9.852  -10.537 -6.797  1.00 19.19 ? 8   DT  B C7    1 
ATOM   354 C C6    . DT  B 2 8 ? -11.706 -11.406 -8.230  1.00 18.17 ? 8   DT  B C6    1 
HETATM 355 N N1    . 5CM B 2 9 ? -16.751 -8.789  -8.192  1.00 15.91 ? 9   5CM B N1    1 
HETATM 356 C C2    . 5CM B 2 9 ? -17.010 -8.680  -6.810  1.00 15.46 ? 9   5CM B C2    1 
HETATM 357 N N3    . 5CM B 2 9 ? -15.952 -8.354  -5.961  1.00 16.40 ? 9   5CM B N3    1 
HETATM 358 C C4    . 5CM B 2 9 ? -14.755 -8.183  -6.549  1.00 15.94 ? 9   5CM B C4    1 
HETATM 359 C C5    . 5CM B 2 9 ? -14.458 -8.283  -7.932  1.00 15.11 ? 9   5CM B C5    1 
HETATM 360 C C5A   . 5CM B 2 9 ? -13.097 -8.066  -8.461  1.00 17.06 ? 9   5CM B C5A   1 
HETATM 361 C C6    . 5CM B 2 9 ? -15.500 -8.614  -8.754  1.00 16.14 ? 9   5CM B C6    1 
HETATM 362 O O2    . 5CM B 2 9 ? -18.152 -8.843  -6.373  1.00 17.08 ? 9   5CM B O2    1 
HETATM 363 N N4    . 5CM B 2 9 ? -13.724 -7.867  -5.643  1.00 18.39 ? 9   5CM B N4    1 
HETATM 364 C "C1'" . 5CM B 2 9 ? -17.868 -9.178  -9.092  1.00 16.91 ? 9   5CM B "C1'" 1 
HETATM 365 C "C2'" . 5CM B 2 9 ? -18.637 -7.931  -9.565  1.00 18.28 ? 9   5CM B "C2'" 1 
HETATM 366 C "C3'" . 5CM B 2 9 ? -18.124 -7.786  -10.991 1.00 15.96 ? 9   5CM B "C3'" 1 
HETATM 367 C "C4'" . 5CM B 2 9 ? -17.825 -9.257  -11.382 1.00 17.82 ? 9   5CM B "C4'" 1 
HETATM 368 O "O4'" . 5CM B 2 9 ? -17.342 -9.858  -10.198 1.00 16.01 ? 9   5CM B "O4'" 1 
HETATM 369 O "O3'" . 5CM B 2 9 ? -19.118 -7.180  -11.778 1.00 18.69 ? 9   5CM B "O3'" 1 
HETATM 370 C "C5'" . 5CM B 2 9 ? -16.697 -9.296  -12.474 1.00 17.76 ? 9   5CM B "C5'" 1 
HETATM 371 O "O5'" . 5CM B 2 9 ? -15.626 -8.682  -11.918 1.00 17.16 ? 9   5CM B "O5'" 1 
HETATM 372 P P     . 5CM B 2 9 ? -14.147 -8.737  -12.853 1.00 16.90 ? 9   5CM B P     1 
HETATM 373 O OP1   . 5CM B 2 9 ? -14.600 -8.460  -14.286 1.00 20.54 ? 9   5CM B OP1   1 
HETATM 374 O OP2   . 5CM B 2 9 ? -13.211 -7.742  -12.188 1.00 18.26 ? 9   5CM B OP2   1 
HETATM 375 N N1    . SPM C 3 . ? -22.261 -8.220  -13.046 1.00 28.95 ? 101 SPM B N1    1 
HETATM 376 C C2    . SPM C 3 . ? -22.169 -9.188  -14.124 1.00 24.51 ? 101 SPM B C2    1 
HETATM 377 C C3    . SPM C 3 . ? -21.215 -8.712  -15.218 1.00 27.31 ? 101 SPM B C3    1 
HETATM 378 C C4    . SPM C 3 . ? -21.018 -9.846  -16.225 1.00 23.99 ? 101 SPM B C4    1 
HETATM 379 N N5    . SPM C 3 . ? -20.040 -9.467  -17.232 1.00 26.62 ? 101 SPM B N5    1 
HETATM 380 C C6    . SPM C 3 . ? -18.718 -9.387  -16.636 1.00 24.56 ? 101 SPM B C6    1 
HETATM 381 C C7    . SPM C 3 . ? -18.151 -10.785 -16.396 1.00 18.89 ? 101 SPM B C7    1 
HETATM 382 C C8    . SPM C 3 . ? -16.633 -10.686 -16.333 1.00 23.80 ? 101 SPM B C8    1 
HETATM 383 C C9    . SPM C 3 . ? -16.037 -12.013 -15.872 1.00 22.24 ? 101 SPM B C9    1 
HETATM 384 N N10   . SPM C 3 . ? -14.589 -11.892 -15.773 1.00 23.02 ? 101 SPM B N10   1 
HETATM 385 C C11   . SPM C 3 . ? -14.017 -13.213 -15.655 1.00 20.47 ? 101 SPM B C11   1 
HETATM 386 C C12   . SPM C 3 . ? -12.660 -13.129 -14.980 1.00 27.29 ? 101 SPM B C12   1 
HETATM 387 C C13   . SPM C 3 . ? -11.553 -13.083 -16.022 1.00 28.32 ? 101 SPM B C13   1 
HETATM 388 N N14   . SPM C 3 . ? -10.872 -11.825 -15.861 1.00 28.15 ? 101 SPM B N14   1 
HETATM 389 O O     . HOH D 4 . ? -13.415 -24.254 4.023   1.00 31.39 ? 101 HOH A O     1 
HETATM 390 O O     . HOH D 4 . ? -16.949 -21.437 -3.866  1.00 30.11 ? 102 HOH A O     1 
HETATM 391 O O     . HOH D 4 . ? -21.678 -16.535 -7.827  1.00 29.16 ? 103 HOH A O     1 
HETATM 392 O O     . HOH D 4 . ? -22.073 -13.696 4.485   1.00 32.03 ? 104 HOH A O     1 
HETATM 393 O O     . HOH D 4 . ? -20.448 -19.723 -1.150  1.00 36.44 ? 105 HOH A O     1 
HETATM 394 O O     . HOH D 4 . ? -2.634  -31.504 2.212   1.00 33.00 ? 106 HOH A O     1 
HETATM 395 O O     . HOH D 4 . ? -3.403  -24.477 12.317  1.00 25.71 ? 107 HOH A O     1 
HETATM 396 O O     . HOH D 4 . ? -22.445 -6.735  3.484   1.00 26.97 ? 108 HOH A O     1 
HETATM 397 O O     . HOH D 4 . ? -20.621 -22.968 -5.195  1.00 32.32 ? 109 HOH A O     1 
HETATM 398 O O     . HOH D 4 . ? -7.747  -24.832 -6.319  1.00 26.16 ? 110 HOH A O     1 
HETATM 399 O O     . HOH D 4 . ? -9.933  -27.160 5.262   1.00 25.30 ? 111 HOH A O     1 
HETATM 400 O O     . HOH D 4 . ? -14.190 -22.813 -0.056  1.00 31.00 ? 112 HOH A O     1 
HETATM 401 O O     . HOH D 4 . ? -12.067 -7.661  -1.428  1.00 31.87 ? 113 HOH A O     1 
HETATM 402 O O     . HOH D 4 . ? -15.366 -20.275 -1.173  1.00 29.17 ? 114 HOH A O     1 
HETATM 403 O O     . HOH D 4 . ? -14.251 -17.290 -0.953  1.00 23.05 ? 115 HOH A O     1 
HETATM 404 O O     A HOH D 4 . ? -14.427 -13.864 0.401   0.51 22.54 ? 116 HOH A O     1 
HETATM 405 O O     B HOH D 4 . ? -15.854 -14.678 0.482   0.49 24.78 ? 116 HOH A O     1 
HETATM 406 O O     . HOH D 4 . ? -0.936  -27.542 10.943  1.00 28.44 ? 117 HOH A O     1 
HETATM 407 O O     . HOH D 4 . ? -20.392 -11.073 -4.990  1.00 21.29 ? 118 HOH A O     1 
HETATM 408 O O     . HOH D 4 . ? -17.089 -17.947 -2.430  1.00 23.10 ? 119 HOH A O     1 
HETATM 409 O O     . HOH D 4 . ? -5.346  -22.616 -0.743  1.00 31.75 ? 120 HOH A O     1 
HETATM 410 O O     . HOH D 4 . ? -25.127 -15.079 -1.003  1.00 31.37 ? 121 HOH A O     1 
HETATM 411 O O     . HOH D 4 . ? -12.506 -10.617 0.051   1.00 30.42 ? 122 HOH A O     1 
HETATM 412 O O     . HOH D 4 . ? -22.927 -18.691 -1.156  1.00 33.39 ? 123 HOH A O     1 
HETATM 413 O O     . HOH D 4 . ? -7.611  -22.157 -5.326  1.00 28.73 ? 124 HOH A O     1 
HETATM 414 O O     . HOH D 4 . ? -17.738 -22.012 -11.006 1.00 28.64 ? 125 HOH A O     1 
HETATM 415 O O     . HOH D 4 . ? -17.786 -17.085 -0.001  1.00 29.32 ? 126 HOH A O     1 
HETATM 416 O O     . HOH D 4 . ? -18.360 -24.649 -10.445 1.00 32.79 ? 127 HOH A O     1 
HETATM 417 O O     . HOH D 4 . ? -1.147  -26.779 2.486   1.00 31.08 ? 128 HOH A O     1 
HETATM 418 O O     . HOH D 4 . ? -0.217  -28.831 3.934   1.00 32.50 ? 129 HOH A O     1 
HETATM 419 O O     . HOH D 4 . ? -2.659  -31.779 14.125  1.00 33.46 ? 130 HOH A O     1 
HETATM 420 O O     . HOH D 4 . ? -4.741  -32.756 1.064   1.00 36.92 ? 131 HOH A O     1 
HETATM 421 O O     . HOH E 4 . ? -8.692  -12.344 -15.131 1.00 32.75 ? 201 HOH B O     1 
HETATM 422 O O     . HOH E 4 . ? -19.704 -21.176 8.762   1.00 31.45 ? 202 HOH B O     1 
HETATM 423 O O     . HOH E 4 . ? -3.632  -10.442 -9.630  1.00 36.19 ? 203 HOH B O     1 
HETATM 424 O O     . HOH E 4 . ? -13.173 -8.138  -16.336 1.00 31.24 ? 204 HOH B O     1 
HETATM 425 O O     . HOH E 4 . ? -10.833 -6.838  -12.223 1.00 32.23 ? 205 HOH B O     1 
HETATM 426 O O     . HOH E 4 . ? -7.536  -11.951 2.633   1.00 26.19 ? 206 HOH B O     1 
HETATM 427 O O     . HOH E 4 . ? -12.338 -16.640 2.147   1.00 30.20 ? 207 HOH B O     1 
HETATM 428 O O     . HOH E 4 . ? -2.697  -11.064 -3.932  1.00 32.25 ? 208 HOH B O     1 
HETATM 429 O O     . HOH E 4 . ? -18.593 -6.583  -14.292 1.00 19.99 ? 209 HOH B O     1 
HETATM 430 O O     . HOH E 4 . ? -20.607 -5.163  -10.788 1.00 24.66 ? 210 HOH B O     1 
HETATM 431 O O     . HOH E 4 . ? -7.211  -13.428 0.342   1.00 23.14 ? 211 HOH B O     1 
HETATM 432 O O     . HOH E 4 . ? -9.121  -8.728  -13.985 1.00 33.86 ? 212 HOH B O     1 
HETATM 433 O O     . HOH E 4 . ? -6.053  -9.008  -8.603  1.00 31.69 ? 213 HOH B O     1 
HETATM 434 O O     . HOH E 4 . ? -16.206 -6.661  -15.551 1.00 23.06 ? 214 HOH B O     1 
HETATM 435 O O     . HOH E 4 . ? -12.265 -13.633 8.619   1.00 33.12 ? 215 HOH B O     1 
HETATM 436 O O     . HOH E 4 . ? -14.690 -24.788 6.348   1.00 25.34 ? 216 HOH B O     1 
HETATM 437 O O     . HOH E 4 . ? -9.018  -13.785 5.550   1.00 27.07 ? 217 HOH B O     1 
HETATM 438 O O     . HOH E 4 . ? -20.419 -16.739 10.826  1.00 34.20 ? 218 HOH B O     1 
HETATM 439 O O     . HOH E 4 . ? -6.386  -20.129 -6.576  1.00 22.67 ? 219 HOH B O     1 
HETATM 440 O O     . HOH E 4 . ? -4.938  -22.036 3.190   1.00 26.79 ? 220 HOH B O     1 
HETATM 441 O O     . HOH E 4 . ? -11.161 -9.054  -15.767 1.00 35.18 ? 221 HOH B O     1 
HETATM 442 O O     . HOH E 4 . ? -13.928 -15.102 15.173  1.00 32.23 ? 222 HOH B O     1 
HETATM 443 O O     . HOH E 4 . ? -13.898 -15.524 8.417   1.00 33.73 ? 223 HOH B O     1 
HETATM 444 O O     . HOH E 4 . ? -17.217 -15.831 10.724  1.00 34.96 ? 224 HOH B O     1 
HETATM 445 O O     . HOH E 4 . ? -5.952  -9.563  -6.003  1.00 30.11 ? 225 HOH B O     1 
HETATM 446 O O     . HOH E 4 . ? -20.945 -8.419  -6.469  1.00 25.43 ? 226 HOH B O     1 
HETATM 447 O O     . HOH E 4 . ? -15.695 -18.989 9.153   1.00 23.27 ? 227 HOH B O     1 
HETATM 448 O O     . HOH E 4 . ? -10.013 -9.006  -3.417  1.00 28.76 ? 228 HOH B O     1 
HETATM 449 O O     . HOH E 4 . ? -19.100 -17.166 14.758  1.00 30.90 ? 229 HOH B O     1 
HETATM 450 O O     . HOH E 4 . ? -5.832  -10.167 -1.349  1.00 32.88 ? 230 HOH B O     1 
HETATM 451 O O     . HOH E 4 . ? -13.808 -18.452 4.864   1.00 31.71 ? 231 HOH B O     1 
HETATM 452 O O     . HOH E 4 . ? -10.974 -6.835  -5.718  1.00 24.92 ? 232 HOH B O     1 
HETATM 453 O O     . HOH E 4 . ? -9.802  -13.945 -0.287  1.00 23.64 ? 233 HOH B O     1 
HETATM 454 O O     . HOH E 4 . ? -15.241 -20.334 6.514   1.00 28.77 ? 234 HOH B O     1 
HETATM 455 O O     . HOH E 4 . ? -2.225  -14.606 -9.591  1.00 31.58 ? 235 HOH B O     1 
HETATM 456 O O     . HOH E 4 . ? -20.981 -27.408 11.140  1.00 29.78 ? 236 HOH B O     1 
HETATM 457 O O     . HOH E 4 . ? -5.668  -9.956  1.780   1.00 35.94 ? 237 HOH B O     1 
HETATM 458 O O     . HOH E 4 . ? -19.193 -23.606 8.324   1.00 28.76 ? 238 HOH B O     1 
HETATM 459 O O     . HOH E 4 . ? -11.597 -13.857 4.341   1.00 33.08 ? 239 HOH B O     1 
HETATM 460 O O     . HOH E 4 . ? -17.239 -21.667 5.654   1.00 38.29 ? 240 HOH B O     1 
HETATM 461 O O     . HOH E 4 . ? -7.560  -8.556  -3.925  1.00 36.45 ? 241 HOH B O     1 
HETATM 462 O O     . HOH E 4 . ? -14.746 -16.426 5.808   1.00 38.58 ? 242 HOH B O     1 
HETATM 463 O O     . HOH E 4 . ? -5.319  -6.186  -8.744  1.00 43.53 ? 243 HOH B O     1 
# 
