data_9K7R
# 
_entry.id   9K7R 
# 
_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   9K7R         pdb_00009k7r 10.2210/pdb9k7r/pdb 
WWPDB D_1300052940 ?            ?                   
# 
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                        9K7R 
_pdbx_database_status.recvd_initial_deposition_date   2024-10-24 
_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_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   69 ? ? ? ? 
# 
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  101 101 SPM SPM A . 
D 4 HOH 1  201 17  HOH HOH A . 
D 4 HOH 2  202 26  HOH HOH A . 
D 4 HOH 3  203 61  HOH HOH A . 
D 4 HOH 4  204 11  HOH HOH A . 
D 4 HOH 5  205 71  HOH HOH A . 
D 4 HOH 6  206 40  HOH HOH A . 
D 4 HOH 7  207 6   HOH HOH A . 
D 4 HOH 8  208 37  HOH HOH A . 
D 4 HOH 9  209 70  HOH HOH A . 
D 4 HOH 10 210 18  HOH HOH A . 
D 4 HOH 11 211 3   HOH HOH A . 
D 4 HOH 12 212 31  HOH HOH A . 
D 4 HOH 13 213 36  HOH HOH A . 
D 4 HOH 14 214 2   HOH HOH A . 
D 4 HOH 15 215 29  HOH HOH A . 
D 4 HOH 16 216 4   HOH HOH A . 
D 4 HOH 17 217 35  HOH HOH A . 
D 4 HOH 18 218 56  HOH HOH A . 
D 4 HOH 19 219 74  HOH HOH A . 
D 4 HOH 20 220 55  HOH HOH A . 
D 4 HOH 21 221 68  HOH HOH A . 
D 4 HOH 22 222 23  HOH HOH A . 
D 4 HOH 23 223 76  HOH HOH A . 
D 4 HOH 24 224 53  HOH HOH A . 
D 4 HOH 25 225 60  HOH HOH A . 
D 4 HOH 26 226 44  HOH HOH A . 
D 4 HOH 27 227 65  HOH HOH A . 
D 4 HOH 28 228 52  HOH HOH A . 
D 4 HOH 29 229 50  HOH HOH A . 
D 4 HOH 30 230 75  HOH HOH A . 
D 4 HOH 31 231 69  HOH HOH A . 
E 4 HOH 1  101 30  HOH HOH B . 
E 4 HOH 2  102 33  HOH HOH B . 
E 4 HOH 3  103 24  HOH HOH B . 
E 4 HOH 4  104 66  HOH HOH B . 
E 4 HOH 5  105 45  HOH HOH B . 
E 4 HOH 6  106 20  HOH HOH B . 
E 4 HOH 7  107 13  HOH HOH B . 
E 4 HOH 8  108 1   HOH HOH B . 
E 4 HOH 9  109 39  HOH HOH B . 
E 4 HOH 10 110 7   HOH HOH B . 
E 4 HOH 11 111 12  HOH HOH B . 
E 4 HOH 12 112 72  HOH HOH B . 
E 4 HOH 13 113 15  HOH HOH B . 
E 4 HOH 14 114 41  HOH HOH B . 
E 4 HOH 15 115 42  HOH HOH B . 
E 4 HOH 16 116 62  HOH HOH B . 
E 4 HOH 17 117 22  HOH HOH B . 
E 4 HOH 18 118 8   HOH HOH B . 
E 4 HOH 19 119 51  HOH HOH B . 
E 4 HOH 20 120 67  HOH HOH B . 
E 4 HOH 21 121 34  HOH HOH B . 
E 4 HOH 22 122 48  HOH HOH B . 
E 4 HOH 23 123 43  HOH HOH B . 
E 4 HOH 24 124 63  HOH HOH B . 
E 4 HOH 25 125 16  HOH HOH B . 
E 4 HOH 26 126 49  HOH HOH B . 
E 4 HOH 27 127 28  HOH HOH B . 
E 4 HOH 28 128 32  HOH HOH B . 
E 4 HOH 29 129 9   HOH HOH B . 
E 4 HOH 30 130 21  HOH HOH B . 
E 4 HOH 31 131 73  HOH HOH B . 
E 4 HOH 32 132 14  HOH HOH B . 
E 4 HOH 33 133 10  HOH HOH B . 
E 4 HOH 34 134 47  HOH HOH B . 
E 4 HOH 35 135 64  HOH HOH B . 
E 4 HOH 36 136 57  HOH HOH B . 
E 4 HOH 37 137 58  HOH HOH B . 
E 4 HOH 38 138 59  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                     9K7R 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     48.472 
_cell.length_a_esd                 ? 
_cell.length_b                     48.472 
_cell.length_b_esd                 ? 
_cell.length_c                     45.555 
_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                         9K7R 
_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                   9K7R 
_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             2.78 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          55.71 
_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         2024-06-25 
_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                                       9K7R 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.59 
_reflns.d_resolution_low                               24.24 
_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                                     8199 
_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                                5.1 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          22.36 
_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                                0.039 
_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                                   1.0 
_reflns.pdbx_CC_star                                   ? 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_Rmerge_I_obs                              0.035 
_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 
1.60 1.7   ? ? ? ? ? ? 1353 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.433 ? ? 1 1 0.924 ? ? ? ? 0.386 ? ? ? ? ? ? ? ? ? 
1.70 1.8   ? ? ? ? ? ? 1046 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.269 ? ? 2 1 0.96  ? ? ? ? 0.237 ? ? ? ? ? ? ? ? ? 
1.80 1.9   ? ? ? ? ? ? 850  ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.181 ? ? 3 1 0.981 ? ? ? ? 0.16  ? ? ? ? ? ? ? ? ? 
1.90 2.0   ? ? ? ? ? ? 690  ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.129 ? ? 4 1 0.99  ? ? ? ? 0.115 ? ? ? ? ? ? ? ? ? 
2.00 3.0   ? ? ? ? ? ? 2919 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.052 ? ? 5 1 0.999 ? ? ? ? 0.047 ? ? ? ? ? ? ? ? ? 
3.00 4.0   ? ? ? ? ? ? 719  ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.029 ? ? 6 1 0.999 ? ? ? ? 0.026 ? ? ? ? ? ? ? ? ? 
4.00 5.0   ? ? ? ? ? ? 254  ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.028 ? ? 7 1 0.999 ? ? ? ? 0.025 ? ? ? ? ? ? ? ? ? 
5.00 24.24 ? ? ? ? ? ? 280  ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 0.026 ? ? 8 1 0.999 ? ? ? ? 0.023 ? ? ? ? ? ? ? ? ? 
# 
_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                                 9K7R 
_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                            1.59 
_refine.ls_d_res_low                             24.24 
_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                     8199 
_refine.ls_number_reflns_R_free                  814 
_refine.ls_number_reflns_R_work                  ? 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    99.62 
_refine.ls_percent_reflns_R_free                 9.93 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.1823 
_refine.ls_R_factor_R_free                       0.1961 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.1807 
_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                          1.38 
_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                      ? 
_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                 26.92 
_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                            0.14 
_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.pdbx_number_atoms_protein        0 
_refine_hist.pdbx_number_atoms_nucleic_acid   374 
_refine_hist.pdbx_number_atoms_ligand         14 
_refine_hist.number_atoms_solvent             69 
_refine_hist.number_atoms_total               457 
_refine_hist.d_res_high                       1.59 
_refine_hist.d_res_low                        24.24 
# 
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' ? 0.008  ? ?   ? f_bond_d           ? ? 
'X-RAY DIFFRACTION' ? 1.043  ? ?   ? f_angle_d          ? ? 
'X-RAY DIFFRACTION' ? 10.562 ? 189 ? f_dihedral_angle_d ? ? 
'X-RAY DIFFRACTION' ? 0.039  ? 78  ? f_chiral_restr     ? ? 
'X-RAY DIFFRACTION' ? 0.007  ? 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' 1.59 1.69  . . 130 1215 98.00  . . . . 0.2413 . . . . . . . . . . . 0.2511 
'X-RAY DIFFRACTION' 1.69 1.82  . . 137 1219 100.00 . . . . 0.1904 . . . . . . . . . . . 0.2318 
'X-RAY DIFFRACTION' 1.82 2.01  . . 135 1236 100.00 . . . . 0.2267 . . . . . . . . . . . 0.2211 
'X-RAY DIFFRACTION' 2.01 2.30  . . 133 1232 100.00 . . . . 0.2189 . . . . . . . . . . . 0.2488 
'X-RAY DIFFRACTION' 2.30 2.89  . . 140 1232 100.00 . . . . 0.2204 . . . . . . . . . . . 0.2400 
'X-RAY DIFFRACTION' 2.89 24.24 . . 139 1251 100.00 . . . . 0.1434 . . . . . . . . . . . 0.1528 
# 
_struct.entry_id                     9K7R 
_struct.title                        
'Crystal structure of DNA/RNA duplex obtained using the counter diffusion method on Earth (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        9K7R 
_struct_keywords.text            'counter diffusion method, 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 9K7R 9K7R ? 1 ? 1 
2 PDB 9K7R 9K7R ? 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 9K7R A 1 ? 9 ? 9K7R 1 ? 9 ? 1 9 
2 2 9K7R B 1 ? 9 ? 9K7R 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         0    ? 
1 'SSA (A^2)'  3470 ? 
# 
_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 ? ? ? ? ? ? ?            1.605 ? ? 
covale2  covale both ? B DT  8 "O3'" ? ? ? 1_555 B 5CM 9 P  ? ? B DT  8 B 5CM 9 1_555 ? ? ? ? ? ? ?            1.601 ? ? 
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                   9K7R 
_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   9K7R 
_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 -0.314 -0.152 -0.111 -7.619  -12.482 0.379  1 A_G1:5CM9_B A 1 ? B 9 ? 19 1 
1 A A 2 1_555 B DT  8 1_555 0.011  -0.178 0.001  -3.974  -16.514 2.692  2 A_A2:DT8_B  A 2 ? B 8 ? 20 1 
1 A A 3 1_555 B DT  7 1_555 -0.001 -0.106 0.040  -5.567  -20.089 6.135  3 A_A3:DT7_B  A 3 ? B 7 ? 20 1 
1 A G 4 1_555 B DC  6 1_555 -0.212 -0.225 -0.112 -11.266 -10.320 -1.801 4 A_G4:DC6_B  A 4 ? B 6 ? 19 1 
1 A A 5 1_555 B DT  5 1_555 0.118  -0.093 -0.253 -11.255 -6.466  -4.594 5 A_A5:DT5_B  A 5 ? B 5 ? 20 1 
1 A A 6 1_555 B DT  4 1_555 0.025  -0.254 0.110  -1.320  -7.558  2.997  6 A_A6:DT4_B  A 6 ? B 4 ? 20 1 
1 A G 7 1_555 B DC  3 1_555 -0.002 0.008  0.019  -3.630  -11.253 2.379  7 A_G7:DC3_B  A 7 ? B 3 ? 19 1 
1 A A 8 1_555 B DT  2 1_555 -0.043 -0.231 -0.027 -0.497  -3.238  -1.966 8 A_A8:DT2_B  A 8 ? B 2 ? 20 1 
1 A G 9 1_555 B 5CM 1 1_555 -0.129 -0.137 0.030  7.962   -0.270  0.406  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 0.428  -1.180 3.175 0.876  1.660  35.795 -2.147 -0.575 3.128 2.698  -1.424 
35.843 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 0.361  -1.181 3.296 0.315  3.915  32.956 -2.716 -0.580 3.142 6.871  -0.552 
33.183 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 -1.293 -1.314 3.298 -3.389 11.298 35.819 -3.457 1.577  2.874 17.785 5.335  
37.651 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 0.823  -1.795 3.349 5.288  12.895 30.055 -5.203 -0.607 2.497 23.353 -9.576 
33.062 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 0.786  -1.579 3.129 -0.357 2.202  25.586 -4.133 -1.863 2.974 4.961  0.803  
25.682 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 0.181  -1.584 3.386 0.081  3.777  31.921 -3.543 -0.313 3.183 6.837  -0.147 
32.137 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 -1.046 -1.420 3.141 -0.948 7.998  34.514 -3.414 1.591  2.780 13.258 1.571  
35.414 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 0.696  -1.906 3.111 0.690  0.963  27.635 -4.207 -1.298 3.061 2.015  -1.444 
27.659 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.id               1 
_pdbx_initial_refinement_model.entity_id_list   ? 
_pdbx_initial_refinement_model.type             'experimental model' 
_pdbx_initial_refinement_model.source_name      PDB 
_pdbx_initial_refinement_model.accession_code   4U6M 
_pdbx_initial_refinement_model.details          ? 
# 
_atom_sites.entry_id                    9K7R 
_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]   0.020630 
_atom_sites.fract_transf_matrix[1][2]   0.011911 
_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]   0.023822 
_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]   0.021951 
_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 ? -14.804 -10.559 -4.830  1.00 34.57 ? 1   G   A "O5'" 1 
ATOM   2   C "C5'" . G   A 1 1 ? -14.976 -11.924 -5.174  1.00 31.84 ? 1   G   A "C5'" 1 
ATOM   3   C "C4'" . G   A 1 1 ? -15.466 -12.728 -3.996  1.00 30.84 ? 1   G   A "C4'" 1 
ATOM   4   O "O4'" . G   A 1 1 ? -14.457 -12.755 -2.957  1.00 29.79 ? 1   G   A "O4'" 1 
ATOM   5   C "C3'" . G   A 1 1 ? -16.699 -12.190 -3.291  1.00 29.77 ? 1   G   A "C3'" 1 
ATOM   6   O "O3'" . G   A 1 1 ? -17.896 -12.528 -3.955  1.00 29.39 ? 1   G   A "O3'" 1 
ATOM   7   C "C2'" . G   A 1 1 ? -16.588 -12.808 -1.905  1.00 27.74 ? 1   G   A "C2'" 1 
ATOM   8   O "O2'" . G   A 1 1 ? -17.033 -14.155 -1.917  1.00 28.99 ? 1   G   A "O2'" 1 
ATOM   9   C "C1'" . G   A 1 1 ? -15.077 -12.793 -1.687  1.00 27.49 ? 1   G   A "C1'" 1 
ATOM   10  N N9    . G   A 1 1 ? -14.650 -11.610 -0.927  1.00 26.55 ? 1   G   A N9    1 
ATOM   11  C C8    . G   A 1 1 ? -13.934 -10.543 -1.396  1.00 26.50 ? 1   G   A C8    1 
ATOM   12  N N7    . G   A 1 1 ? -13.698 -9.641  -0.480  1.00 26.98 ? 1   G   A N7    1 
ATOM   13  C C5    . G   A 1 1 ? -14.291 -10.155 0.667   1.00 24.84 ? 1   G   A C5    1 
ATOM   14  C C6    . G   A 1 1 ? -14.368 -9.619  1.978   1.00 24.84 ? 1   G   A C6    1 
ATOM   15  O O6    . G   A 1 1 ? -13.909 -8.566  2.424   1.00 24.54 ? 1   G   A O6    1 
ATOM   16  N N1    . G   A 1 1 ? -15.069 -10.473 2.818   1.00 22.85 ? 1   G   A N1    1 
ATOM   17  C C2    . G   A 1 1 ? -15.633 -11.667 2.455   1.00 21.43 ? 1   G   A C2    1 
ATOM   18  N N2    . G   A 1 1 ? -16.266 -12.325 3.428   1.00 21.96 ? 1   G   A N2    1 
ATOM   19  N N3    . G   A 1 1 ? -15.575 -12.182 1.242   1.00 24.46 ? 1   G   A N3    1 
ATOM   20  C C4    . G   A 1 1 ? -14.889 -11.370 0.407   1.00 24.82 ? 1   G   A C4    1 
ATOM   21  P P     . A   A 1 2 ? -19.114 -11.492 -3.988  1.00 30.24 ? 2   A   A P     1 
ATOM   22  O OP1   . A   A 1 2 ? -20.124 -12.045 -4.932  1.00 34.95 ? 2   A   A OP1   1 
ATOM   23  O OP2   . A   A 1 2 ? -18.551 -10.137 -4.203  1.00 31.46 ? 2   A   A OP2   1 
ATOM   24  O "O5'" . A   A 1 2 ? -19.707 -11.564 -2.510  1.00 26.84 ? 2   A   A "O5'" 1 
ATOM   25  C "C5'" . A   A 1 2 ? -20.254 -12.775 -2.016  1.00 26.55 ? 2   A   A "C5'" 1 
ATOM   26  C "C4'" . A   A 1 2 ? -20.393 -12.744 -0.519  1.00 27.55 ? 2   A   A "C4'" 1 
ATOM   27  O "O4'" . A   A 1 2 ? -19.108 -12.474 0.091   1.00 26.77 ? 2   A   A "O4'" 1 
ATOM   28  C "C3'" . A   A 1 2 ? -21.286 -11.661 0.051   1.00 25.02 ? 2   A   A "C3'" 1 
ATOM   29  O "O3'" . A   A 1 2 ? -22.654 -11.991 -0.022  1.00 27.13 ? 2   A   A "O3'" 1 
ATOM   30  C "C2'" . A   A 1 2 ? -20.797 -11.571 1.481   1.00 22.63 ? 2   A   A "C2'" 1 
ATOM   31  O "O2'" . A   A 1 2 ? -21.274 -12.694 2.207   1.00 26.96 ? 2   A   A "O2'" 1 
ATOM   32  C "C1'" . A   A 1 2 ? -19.295 -11.745 1.286   1.00 23.74 ? 2   A   A "C1'" 1 
ATOM   33  N N9    . A   A 1 2 ? -18.579 -10.463 1.170   1.00 21.08 ? 2   A   A N9    1 
ATOM   34  C C8    . A   A 1 2 ? -18.097 -9.866  0.030   1.00 25.29 ? 2   A   A C8    1 
ATOM   35  N N7    . A   A 1 2 ? -17.487 -8.729  0.251   1.00 20.82 ? 2   A   A N7    1 
ATOM   36  C C5    . A   A 1 2 ? -17.578 -8.573  1.628   1.00 20.72 ? 2   A   A C5    1 
ATOM   37  C C6    . A   A 1 2 ? -17.118 -7.572  2.487   1.00 19.94 ? 2   A   A C6    1 
ATOM   38  N N6    . A   A 1 2 ? -16.459 -6.489  2.078   1.00 23.13 ? 2   A   A N6    1 
ATOM   39  N N1    . A   A 1 2 ? -17.373 -7.711  3.806   1.00 18.64 ? 2   A   A N1    1 
ATOM   40  C C2    . A   A 1 2 ? -18.038 -8.795  4.214   1.00 20.35 ? 2   A   A C2    1 
ATOM   41  N N3    . A   A 1 2 ? -18.512 -9.808  3.498   1.00 21.21 ? 2   A   A N3    1 
ATOM   42  C C4    . A   A 1 2 ? -18.247 -9.627  2.203   1.00 21.58 ? 2   A   A C4    1 
ATOM   43  P P     . A   A 1 3 ? -23.757 -10.832 -0.092  1.00 25.85 ? 3   A   A P     1 
ATOM   44  O OP1   . A   A 1 3 ? -25.060 -11.509 -0.301  1.00 29.40 ? 3   A   A OP1   1 
ATOM   45  O OP2   . A   A 1 3 ? -23.268 -9.779  -1.000  1.00 26.18 ? 3   A   A OP2   1 
ATOM   46  O "O5'" . A   A 1 3 ? -23.754 -10.179 1.362   1.00 24.68 ? 3   A   A "O5'" 1 
ATOM   47  C "C5'" . A   A 1 3 ? -24.216 -10.891 2.498   1.00 25.06 ? 3   A   A "C5'" 1 
ATOM   48  C "C4'" . A   A 1 3 ? -23.820 -10.187 3.770   1.00 23.60 ? 3   A   A "C4'" 1 
ATOM   49  O "O4'" . A   A 1 3 ? -22.386 -9.971  3.785   1.00 23.56 ? 3   A   A "O4'" 1 
ATOM   50  C "C3'" . A   A 1 3 ? -24.396 -8.795  3.965   1.00 23.31 ? 3   A   A "C3'" 1 
ATOM   51  O "O3'" . A   A 1 3 ? -25.710 -8.805  4.477   1.00 24.78 ? 3   A   A "O3'" 1 
ATOM   52  C "C2'" . A   A 1 3 ? -23.404 -8.154  4.919   1.00 22.54 ? 3   A   A "C2'" 1 
ATOM   53  O "O2'" . A   A 1 3 ? -23.633 -8.592  6.251   1.00 25.15 ? 3   A   A "O2'" 1 
ATOM   54  C "C1'" . A   A 1 3 ? -22.091 -8.750  4.429   1.00 23.89 ? 3   A   A "C1'" 1 
ATOM   55  N N9    . A   A 1 3 ? -21.417 -7.867  3.464   1.00 19.33 ? 3   A   A N9    1 
ATOM   56  C C8    . A   A 1 3 ? -21.345 -7.951  2.097   1.00 22.51 ? 3   A   A C8    1 
ATOM   57  N N7    . A   A 1 3 ? -20.651 -6.982  1.546   1.00 18.74 ? 3   A   A N7    1 
ATOM   58  C C5    . A   A 1 3 ? -20.240 -6.217  2.635   1.00 18.09 ? 3   A   A C5    1 
ATOM   59  C C6    . A   A 1 3 ? -19.463 -5.052  2.754   1.00 18.44 ? 3   A   A C6    1 
ATOM   60  N N6    . A   A 1 3 ? -18.912 -4.400  1.723   1.00 18.48 ? 3   A   A N6    1 
ATOM   61  N N1    . A   A 1 3 ? -19.257 -4.557  3.996   1.00 16.75 ? 3   A   A N1    1 
ATOM   62  C C2    . A   A 1 3 ? -19.778 -5.195  5.057   1.00 18.13 ? 3   A   A C2    1 
ATOM   63  N N3    . A   A 1 3 ? -20.515 -6.304  5.062   1.00 19.03 ? 3   A   A N3    1 
ATOM   64  C C4    . A   A 1 3 ? -20.708 -6.756  3.812   1.00 19.85 ? 3   A   A C4    1 
ATOM   65  P P     . G   A 1 4 ? -26.604 -7.481  4.363   1.00 29.03 ? 4   G   A P     1 
ATOM   66  O OP1   . G   A 1 4 ? -28.012 -7.862  4.672   1.00 32.75 ? 4   G   A OP1   1 
ATOM   67  O OP2   . G   A 1 4 ? -26.296 -6.849  3.055   1.00 27.90 ? 4   G   A OP2   1 
ATOM   68  O "O5'" . G   A 1 4 ? -26.037 -6.508  5.495   1.00 28.06 ? 4   G   A "O5'" 1 
ATOM   69  C "C5'" . G   A 1 4 ? -26.382 -6.654  6.865   1.00 28.24 ? 4   G   A "C5'" 1 
ATOM   70  C "C4'" . G   A 1 4 ? -25.984 -5.429  7.651   1.00 25.90 ? 4   G   A "C4'" 1 
ATOM   71  O "O4'" . G   A 1 4 ? -24.536 -5.287  7.630   1.00 25.03 ? 4   G   A "O4'" 1 
ATOM   72  C "C3'" . G   A 1 4 ? -26.483 -4.105  7.097   1.00 27.34 ? 4   G   A "C3'" 1 
ATOM   73  O "O3'" . G   A 1 4 ? -27.823 -3.806  7.436   1.00 31.16 ? 4   G   A "O3'" 1 
ATOM   74  C "C2'" . G   A 1 4 ? -25.478 -3.115  7.661   1.00 25.88 ? 4   G   A "C2'" 1 
ATOM   75  O "O2'" . G   A 1 4 ? -25.740 -2.887  9.037   1.00 27.61 ? 4   G   A "O2'" 1 
ATOM   76  C "C1'" . G   A 1 4 ? -24.188 -3.918  7.539   1.00 23.81 ? 4   G   A "C1'" 1 
ATOM   77  N N9    . G   A 1 4 ? -23.549 -3.702  6.230   1.00 21.36 ? 4   G   A N9    1 
ATOM   78  C C8    . G   A 1 4 ? -23.674 -4.534  5.138   1.00 20.86 ? 4   G   A C8    1 
ATOM   79  N N7    . G   A 1 4 ? -23.011 -4.116  4.099   1.00 21.06 ? 4   G   A N7    1 
ATOM   80  C C5    . G   A 1 4 ? -22.420 -2.928  4.522   1.00 21.86 ? 4   G   A C5    1 
ATOM   81  C C6    . G   A 1 4 ? -21.569 -2.026  3.827   1.00 18.79 ? 4   G   A C6    1 
ATOM   82  O O6    . G   A 1 4 ? -21.165 -2.084  2.672   1.00 20.20 ? 4   G   A O6    1 
ATOM   83  N N1    . G   A 1 4 ? -21.176 -0.949  4.610   1.00 17.03 ? 4   G   A N1    1 
ATOM   84  C C2    . G   A 1 4 ? -21.556 -0.763  5.915   1.00 19.50 ? 4   G   A C2    1 
ATOM   85  N N2    . G   A 1 4 ? -21.075 0.346   6.501   1.00 21.33 ? 4   G   A N2    1 
ATOM   86  N N3    . G   A 1 4 ? -22.341 -1.593  6.589   1.00 19.21 ? 4   G   A N3    1 
ATOM   87  C C4    . G   A 1 4 ? -22.739 -2.655  5.833   1.00 20.84 ? 4   G   A C4    1 
ATOM   88  P P     . A   A 1 5 ? -28.735 -3.005  6.380   1.00 35.47 ? 5   A   A P     1 
ATOM   89  O OP1   . A   A 1 5 ? -29.995 -2.659  7.098   1.00 38.93 ? 5   A   A OP1   1 
ATOM   90  O OP2   . A   A 1 5 ? -28.766 -3.756  5.101   1.00 34.38 ? 5   A   A OP2   1 
ATOM   91  O "O5'" . A   A 1 5 ? -27.912 -1.675  6.061   1.00 32.85 ? 5   A   A "O5'" 1 
ATOM   92  C "C5'" . A   A 1 5 ? -28.185 -0.474  6.753   1.00 33.53 ? 5   A   A "C5'" 1 
ATOM   93  C "C4'" . A   A 1 5 ? -27.274 0.665   6.357   1.00 30.68 ? 5   A   A "C4'" 1 
ATOM   94  O "O4'" . A   A 1 5 ? -25.895 0.227   6.183   1.00 27.69 ? 5   A   A "O4'" 1 
ATOM   95  C "C3'" . A   A 1 5 ? -27.553 1.396   5.058   1.00 31.34 ? 5   A   A "C3'" 1 
ATOM   96  O "O3'" . A   A 1 5 ? -28.719 2.203   5.063   1.00 34.46 ? 5   A   A "O3'" 1 
ATOM   97  C "C2'" . A   A 1 5 ? -26.263 2.184   4.888   1.00 29.42 ? 5   A   A "C2'" 1 
ATOM   98  O "O2'" . A   A 1 5 ? -26.211 3.261   5.810   1.00 30.19 ? 5   A   A "O2'" 1 
ATOM   99  C "C1'" . A   A 1 5 ? -25.232 1.138   5.319   1.00 27.43 ? 5   A   A "C1'" 1 
ATOM   100 N N9    . A   A 1 5 ? -24.734 0.438   4.126   1.00 24.61 ? 5   A   A N9    1 
ATOM   101 C C8    . A   A 1 5 ? -25.134 -0.758  3.594   1.00 25.83 ? 5   A   A C8    1 
ATOM   102 N N7    . A   A 1 5 ? -24.503 -1.061  2.490   1.00 23.81 ? 5   A   A N7    1 
ATOM   103 C C5    . A   A 1 5 ? -23.660 0.019   2.251   1.00 23.58 ? 5   A   A C5    1 
ATOM   104 C C6    . A   A 1 5 ? -22.727 0.296   1.229   1.00 21.45 ? 5   A   A C6    1 
ATOM   105 N N6    . A   A 1 5 ? -22.484 -0.507  0.187   1.00 20.27 ? 5   A   A N6    1 
ATOM   106 N N1    . A   A 1 5 ? -22.038 1.455   1.303   1.00 21.44 ? 5   A   A N1    1 
ATOM   107 C C2    . A   A 1 5 ? -22.287 2.269   2.341   1.00 21.39 ? 5   A   A C2    1 
ATOM   108 N N3    . A   A 1 5 ? -23.134 2.117   3.360   1.00 22.54 ? 5   A   A N3    1 
ATOM   109 C C4    . A   A 1 5 ? -23.800 0.955   3.255   1.00 22.41 ? 5   A   A C4    1 
ATOM   110 P P     . A   A 1 6 ? -29.485 2.497   3.676   1.00 36.64 ? 6   A   A P     1 
ATOM   111 O OP1   . A   A 1 6 ? -30.789 3.115   4.018   1.00 40.41 ? 6   A   A OP1   1 
ATOM   112 O OP2   . A   A 1 6 ? -29.438 1.286   2.818   1.00 38.40 ? 6   A   A OP2   1 
ATOM   113 O "O5'" . A   A 1 6 ? -28.589 3.589   2.948   1.00 34.31 ? 6   A   A "O5'" 1 
ATOM   114 C "C5'" . A   A 1 6 ? -28.288 4.818   3.579   1.00 33.97 ? 6   A   A "C5'" 1 
ATOM   115 C "C4'" . A   A 1 6 ? -27.087 5.472   2.952   1.00 31.69 ? 6   A   A "C4'" 1 
ATOM   116 O "O4'" . A   A 1 6 ? -25.985 4.530   2.872   1.00 32.37 ? 6   A   A "O4'" 1 
ATOM   117 C "C3'" . A   A 1 6 ? -27.254 5.941   1.524   1.00 33.57 ? 6   A   A "C3'" 1 
ATOM   118 O "O3'" . A   A 1 6 ? -27.978 7.152   1.435   1.00 36.71 ? 6   A   A "O3'" 1 
ATOM   119 C "C2'" . A   A 1 6 ? -25.811 6.043   1.056   1.00 33.44 ? 6   A   A "C2'" 1 
ATOM   120 O "O2'" . A   A 1 6 ? -25.193 7.202   1.600   1.00 34.88 ? 6   A   A "O2'" 1 
ATOM   121 C "C1'" . A   A 1 6 ? -25.201 4.814   1.732   1.00 29.57 ? 6   A   A "C1'" 1 
ATOM   122 N N9    . A   A 1 6 ? -25.206 3.639   0.841   1.00 28.87 ? 6   A   A N9    1 
ATOM   123 C C8    . A   A 1 6 ? -26.018 2.532   0.858   1.00 26.68 ? 6   A   A C8    1 
ATOM   124 N N7    . A   A 1 6 ? -25.751 1.668   -0.093  1.00 28.48 ? 6   A   A N7    1 
ATOM   125 C C5    . A   A 1 6 ? -24.700 2.242   -0.784  1.00 26.79 ? 6   A   A C5    1 
ATOM   126 C C6    . A   A 1 6 ? -23.954 1.829   -1.901  1.00 22.37 ? 6   A   A C6    1 
ATOM   127 N N6    . A   A 1 6 ? -24.142 0.687   -2.561  1.00 24.38 ? 6   A   A N6    1 
ATOM   128 N N1    . A   A 1 6 ? -22.970 2.648   -2.332  1.00 25.36 ? 6   A   A N1    1 
ATOM   129 C C2    . A   A 1 6 ? -22.762 3.791   -1.666  1.00 22.41 ? 6   A   A C2    1 
ATOM   130 N N3    . A   A 1 6 ? -23.392 4.282   -0.611  1.00 23.83 ? 6   A   A N3    1 
ATOM   131 C C4    . A   A 1 6 ? -24.359 3.451   -0.212  1.00 24.45 ? 6   A   A C4    1 
ATOM   132 P P     . G   A 1 7 ? -28.894 7.446   0.149   1.00 40.86 ? 7   G   A P     1 
ATOM   133 O OP1   . G   A 1 7 ? -29.752 8.618   0.464   1.00 40.40 ? 7   G   A OP1   1 
ATOM   134 O OP2   . G   A 1 7 ? -29.532 6.179   -0.285  1.00 35.60 ? 7   G   A OP2   1 
ATOM   135 O "O5'" . G   A 1 7 ? -27.835 7.901   -0.937  1.00 30.93 ? 7   G   A "O5'" 1 
ATOM   136 C "C5'" . G   A 1 7 ? -27.081 9.089   -0.765  1.00 32.18 ? 7   G   A "C5'" 1 
ATOM   137 C "C4'" . G   A 1 7 ? -25.851 9.072   -1.631  1.00 30.14 ? 7   G   A "C4'" 1 
ATOM   138 O "O4'" . G   A 1 7 ? -25.151 7.822   -1.428  1.00 33.84 ? 7   G   A "O4'" 1 
ATOM   139 C "C3'" . G   A 1 7 ? -26.101 9.114   -3.132  1.00 28.11 ? 7   G   A "C3'" 1 
ATOM   140 O "O3'" . G   A 1 7 ? -26.268 10.426  -3.611  1.00 30.33 ? 7   G   A "O3'" 1 
ATOM   141 C "C2'" . G   A 1 7 ? -24.863 8.446   -3.699  1.00 31.99 ? 7   G   A "C2'" 1 
ATOM   142 O "O2'" . G   A 1 7 ? -23.772 9.357   -3.716  1.00 34.89 ? 7   G   A "O2'" 1 
ATOM   143 C "C1'" . G   A 1 7 ? -24.589 7.381   -2.642  1.00 30.20 ? 7   G   A "C1'" 1 
ATOM   144 N N9    . G   A 1 7 ? -25.182 6.073   -2.989  1.00 27.09 ? 7   G   A N9    1 
ATOM   145 C C8    . G   A 1 7 ? -26.216 5.408   -2.382  1.00 30.46 ? 7   G   A C8    1 
ATOM   146 N N7    . G   A 1 7 ? -26.476 4.251   -2.939  1.00 30.22 ? 7   G   A N7    1 
ATOM   147 C C5    . G   A 1 7 ? -25.542 4.147   -3.965  1.00 23.74 ? 7   G   A C5    1 
ATOM   148 C C6    . G   A 1 7 ? -25.306 3.126   -4.929  1.00 25.16 ? 7   G   A C6    1 
ATOM   149 O O6    . G   A 1 7 ? -25.884 2.051   -5.085  1.00 28.70 ? 7   G   A O6    1 
ATOM   150 N N1    . G   A 1 7 ? -24.267 3.442   -5.781  1.00 25.17 ? 7   G   A N1    1 
ATOM   151 C C2    . G   A 1 7 ? -23.543 4.604   -5.721  1.00 26.98 ? 7   G   A C2    1 
ATOM   152 N N2    . G   A 1 7 ? -22.577 4.752   -6.631  1.00 23.14 ? 7   G   A N2    1 
ATOM   153 N N3    . G   A 1 7 ? -23.749 5.562   -4.840  1.00 26.01 ? 7   G   A N3    1 
ATOM   154 C C4    . G   A 1 7 ? -24.752 5.269   -4.005  1.00 27.14 ? 7   G   A C4    1 
ATOM   155 P P     . A   A 1 8 ? -27.304 10.723  -4.795  1.00 26.13 ? 8   A   A P     1 
ATOM   156 O OP1   . A   A 1 8 ? -27.507 12.202  -4.781  1.00 32.25 ? 8   A   A OP1   1 
ATOM   157 O OP2   . A   A 1 8 ? -28.458 9.816   -4.683  1.00 26.35 ? 8   A   A OP2   1 
ATOM   158 O "O5'" . A   A 1 8 ? -26.517 10.349  -6.125  1.00 27.25 ? 8   A   A "O5'" 1 
ATOM   159 C "C5'" . A   A 1 8 ? -25.569 11.243  -6.673  1.00 26.55 ? 8   A   A "C5'" 1 
ATOM   160 C "C4'" . A   A 1 8 ? -24.987 10.712  -7.951  1.00 25.30 ? 8   A   A "C4'" 1 
ATOM   161 O "O4'" . A   A 1 8 ? -24.184 9.527   -7.678  1.00 23.47 ? 8   A   A "O4'" 1 
ATOM   162 C "C3'" . A   A 1 8 ? -25.976 10.230  -9.000  1.00 25.22 ? 8   A   A "C3'" 1 
ATOM   163 O "O3'" . A   A 1 8 ? -26.606 11.272  -9.725  1.00 24.40 ? 8   A   A "O3'" 1 
ATOM   164 C "C2'" . A   A 1 8 ? -25.093 9.333   -9.847  1.00 20.67 ? 8   A   A "C2'" 1 
ATOM   165 O "O2'" . A   A 1 8 ? -24.179 10.120  -10.591 1.00 25.51 ? 8   A   A "O2'" 1 
ATOM   166 C "C1'" . A   A 1 8 ? -24.310 8.615   -8.754  1.00 23.61 ? 8   A   A "C1'" 1 
ATOM   167 N N9    . A   A 1 8 ? -25.061 7.436   -8.275  1.00 22.29 ? 8   A   A N9    1 
ATOM   168 C C8    . A   A 1 8 ? -25.902 7.351   -7.195  1.00 21.68 ? 8   A   A C8    1 
ATOM   169 N N7    . A   A 1 8 ? -26.449 6.169   -7.049  1.00 21.06 ? 8   A   A N7    1 
ATOM   170 C C5    . A   A 1 8 ? -25.948 5.440   -8.117  1.00 18.10 ? 8   A   A C5    1 
ATOM   171 C C6    . A   A 1 8 ? -26.149 4.113   -8.543  1.00 20.37 ? 8   A   A C6    1 
ATOM   172 N N6    . A   A 1 8 ? -26.933 3.247   -7.899  1.00 20.95 ? 8   A   A N6    1 
ATOM   173 N N1    . A   A 1 8 ? -25.502 3.696   -9.650  1.00 19.67 ? 8   A   A N1    1 
ATOM   174 C C2    . A   A 1 8 ? -24.709 4.552   -10.302 1.00 20.18 ? 8   A   A C2    1 
ATOM   175 N N3    . A   A 1 8 ? -24.453 5.823   -9.991  1.00 19.99 ? 8   A   A N3    1 
ATOM   176 C C4    . A   A 1 8 ? -25.103 6.205   -8.885  1.00 19.65 ? 8   A   A C4    1 
ATOM   177 P P     . G   A 1 9 ? -28.112 11.092  -10.283 1.00 22.31 ? 9   G   A P     1 
ATOM   178 O OP1   . G   A 1 9 ? -28.482 12.397  -10.892 1.00 27.67 ? 9   G   A OP1   1 
ATOM   179 O OP2   . G   A 1 9 ? -28.979 10.498  -9.247  1.00 23.35 ? 9   G   A OP2   1 
ATOM   180 O "O5'" . G   A 1 9 ? -27.958 10.068  -11.495 1.00 22.93 ? 9   G   A "O5'" 1 
ATOM   181 C "C5'" . G   A 1 9 ? -27.189 10.402  -12.640 1.00 24.32 ? 9   G   A "C5'" 1 
ATOM   182 C "C4'" . G   A 1 9 ? -26.883 9.191   -13.483 1.00 23.45 ? 9   G   A "C4'" 1 
ATOM   183 O "O4'" . G   A 1 9 ? -26.229 8.175   -12.678 1.00 21.80 ? 9   G   A "O4'" 1 
ATOM   184 C "C3'" . G   A 1 9 ? -28.077 8.466   -14.070 1.00 21.17 ? 9   G   A "C3'" 1 
ATOM   185 O "O3'" . G   A 1 9 ? -28.606 9.099   -15.219 1.00 24.03 ? 9   G   A "O3'" 1 
ATOM   186 C "C2'" . G   A 1 9 ? -27.508 7.081   -14.338 1.00 22.80 ? 9   G   A "C2'" 1 
ATOM   187 O "O2'" . G   A 1 9 ? -26.690 7.071   -15.494 1.00 24.15 ? 9   G   A "O2'" 1 
ATOM   188 C "C1'" . G   A 1 9 ? -26.623 6.890   -13.116 1.00 21.98 ? 9   G   A "C1'" 1 
ATOM   189 N N9    . G   A 1 9 ? -27.408 6.241   -12.062 1.00 18.67 ? 9   G   A N9    1 
ATOM   190 C C8    . G   A 1 9 ? -28.005 6.807   -10.963 1.00 19.06 ? 9   G   A C8    1 
ATOM   191 N N7    . G   A 1 9 ? -28.680 5.943   -10.268 1.00 19.15 ? 9   G   A N7    1 
ATOM   192 C C5    . G   A 1 9 ? -28.517 4.743   -10.945 1.00 17.82 ? 9   G   A C5    1 
ATOM   193 C C6    . G   A 1 9 ? -29.016 3.455   -10.659 1.00 18.47 ? 9   G   A C6    1 
ATOM   194 O O6    . G   A 1 9 ? -29.734 3.107   -9.716  1.00 21.34 ? 9   G   A O6    1 
ATOM   195 N N1    . G   A 1 9 ? -28.628 2.529   -11.615 1.00 17.41 ? 9   G   A N1    1 
ATOM   196 C C2    . G   A 1 9 ? -27.847 2.789   -12.706 1.00 17.92 ? 9   G   A C2    1 
ATOM   197 N N2    . G   A 1 9 ? -27.582 1.747   -13.513 1.00 19.49 ? 9   G   A N2    1 
ATOM   198 N N3    . G   A 1 9 ? -27.373 3.996   -12.992 1.00 19.60 ? 9   G   A N3    1 
ATOM   199 C C4    . G   A 1 9 ? -27.749 4.913   -12.071 1.00 19.50 ? 9   G   A C4    1 
HETATM 200 N N1    . 5CM B 2 1 ? -30.037 -2.279  -12.365 1.00 21.16 ? 1   5CM B N1    1 
HETATM 201 C C2    . 5CM B 2 1 ? -29.452 -0.987  -12.425 1.00 20.09 ? 1   5CM B C2    1 
HETATM 202 N N3    . 5CM B 2 1 ? -29.739 -0.085  -11.420 1.00 20.49 ? 1   5CM B N3    1 
HETATM 203 C C4    . 5CM B 2 1 ? -30.554 -0.508  -10.476 1.00 21.66 ? 1   5CM B C4    1 
HETATM 204 C C5    . 5CM B 2 1 ? -31.154 -1.759  -10.377 1.00 23.28 ? 1   5CM B C5    1 
HETATM 205 C C5A   . 5CM B 2 1 ? -32.041 -2.067  -9.259  1.00 26.79 ? 1   5CM B C5A   1 
HETATM 206 C C6    . 5CM B 2 1 ? -30.884 -2.658  -11.361 1.00 23.36 ? 1   5CM B C6    1 
HETATM 207 O O2    . 5CM B 2 1 ? -28.708 -0.674  -13.333 1.00 21.36 ? 1   5CM B O2    1 
HETATM 208 N N4    . 5CM B 2 1 ? -30.812 0.432   -9.488  1.00 24.81 ? 1   5CM B N4    1 
HETATM 209 C "C1'" . 5CM B 2 1 ? -29.756 -3.265  -13.448 1.00 22.49 ? 1   5CM B "C1'" 1 
HETATM 210 C "C2'" . 5CM B 2 1 ? -28.333 -3.747  -13.268 1.00 22.49 ? 1   5CM B "C2'" 1 
HETATM 211 C "C3'" . 5CM B 2 1 ? -28.516 -5.054  -12.552 1.00 24.12 ? 1   5CM B "C3'" 1 
HETATM 212 C "C4'" . 5CM B 2 1 ? -29.851 -5.514  -13.099 1.00 24.78 ? 1   5CM B "C4'" 1 
HETATM 213 O "O4'" . 5CM B 2 1 ? -30.602 -4.343  -13.320 1.00 24.60 ? 1   5CM B "O4'" 1 
HETATM 214 O "O3'" . 5CM B 2 1 ? -27.475 -5.880  -12.901 1.00 27.62 ? 1   5CM B "O3'" 1 
HETATM 215 C "C5'" . 5CM B 2 1 ? -30.507 -6.313  -11.960 1.00 29.75 ? 1   5CM B "C5'" 1 
HETATM 216 O "O5'" . 5CM B 2 1 ? -31.681 -6.685  -12.487 1.00 35.93 ? 1   5CM B "O5'" 1 
ATOM   217 P P     . DT  B 2 2 ? -26.089 -5.871  -12.092 1.00 27.35 ? 2   DT  B P     1 
ATOM   218 O OP1   . DT  B 2 2 ? -25.270 -7.016  -12.567 1.00 31.50 ? 2   DT  B OP1   1 
ATOM   219 O OP2   . DT  B 2 2 ? -26.402 -5.700  -10.652 1.00 28.57 ? 2   DT  B OP2   1 
ATOM   220 O "O5'" . DT  B 2 2 ? -25.382 -4.522  -12.574 1.00 25.03 ? 2   DT  B "O5'" 1 
ATOM   221 C "C5'" . DT  B 2 2 ? -24.845 -4.409  -13.878 1.00 23.45 ? 2   DT  B "C5'" 1 
ATOM   222 C "C4'" . DT  B 2 2 ? -24.236 -3.033  -14.083 1.00 24.54 ? 2   DT  B "C4'" 1 
ATOM   223 O "O4'" . DT  B 2 2 ? -25.259 -2.019  -13.956 1.00 24.00 ? 2   DT  B "O4'" 1 
ATOM   224 C "C3'" . DT  B 2 2 ? -23.203 -2.619  -13.047 1.00 24.72 ? 2   DT  B "C3'" 1 
ATOM   225 O "O3'" . DT  B 2 2 ? -21.956 -3.192  -13.338 1.00 27.98 ? 2   DT  B "O3'" 1 
ATOM   226 C "C2'" . DT  B 2 2 ? -23.180 -1.116  -13.247 1.00 25.59 ? 2   DT  B "C2'" 1 
ATOM   227 C "C1'" . DT  B 2 2 ? -24.663 -0.830  -13.427 1.00 23.54 ? 2   DT  B "C1'" 1 
ATOM   228 N N1    . DT  B 2 2 ? -25.343 -0.455  -12.162 1.00 21.08 ? 2   DT  B N1    1 
ATOM   229 C C2    . DT  B 2 2 ? -25.204 0.829   -11.712 1.00 20.27 ? 2   DT  B C2    1 
ATOM   230 O O2    . DT  B 2 2 ? -24.548 1.664   -12.296 1.00 21.90 ? 2   DT  B O2    1 
ATOM   231 N N3    . DT  B 2 2 ? -25.863 1.107   -10.556 1.00 20.45 ? 2   DT  B N3    1 
ATOM   232 C C4    . DT  B 2 2 ? -26.636 0.240   -9.812  1.00 20.07 ? 2   DT  B C4    1 
ATOM   233 O O4    . DT  B 2 2 ? -27.204 0.584   -8.785  1.00 22.19 ? 2   DT  B O4    1 
ATOM   234 C C5    . DT  B 2 2 ? -26.740 -1.100  -10.333 1.00 21.01 ? 2   DT  B C5    1 
ATOM   235 C C7    . DT  B 2 2 ? -27.547 -2.127  -9.596  1.00 21.32 ? 2   DT  B C7    1 
ATOM   236 C C6    . DT  B 2 2 ? -26.094 -1.384  -11.474 1.00 22.24 ? 2   DT  B C6    1 
ATOM   237 P P     . DC  B 2 3 ? -20.970 -3.617  -12.141 1.00 28.27 ? 3   DC  B P     1 
ATOM   238 O OP1   . DC  B 2 3 ? -19.868 -4.391  -12.763 1.00 36.12 ? 3   DC  B OP1   1 
ATOM   239 O OP2   . DC  B 2 3 ? -21.790 -4.239  -11.077 1.00 28.62 ? 3   DC  B OP2   1 
ATOM   240 O "O5'" . DC  B 2 3 ? -20.399 -2.229  -11.603 1.00 32.36 ? 3   DC  B "O5'" 1 
ATOM   241 C "C5'" . DC  B 2 3 ? -19.563 -1.433  -12.417 1.00 29.48 ? 3   DC  B "C5'" 1 
ATOM   242 C "C4'" . DC  B 2 3 ? -19.568 0.013   -11.949 1.00 31.00 ? 3   DC  B "C4'" 1 
ATOM   243 O "O4'" . DC  B 2 3 ? -20.928 0.493   -11.823 1.00 30.64 ? 3   DC  B "O4'" 1 
ATOM   244 C "C3'" . DC  B 2 3 ? -18.977 0.249   -10.574 1.00 29.15 ? 3   DC  B "C3'" 1 
ATOM   245 O "O3'" . DC  B 2 3 ? -17.571 0.309   -10.664 1.00 32.02 ? 3   DC  B "O3'" 1 
ATOM   246 C "C2'" . DC  B 2 3 ? -19.576 1.606   -10.228 1.00 29.76 ? 3   DC  B "C2'" 1 
ATOM   247 C "C1'" . DC  B 2 3 ? -20.990 1.473   -10.793 1.00 28.50 ? 3   DC  B "C1'" 1 
ATOM   248 N N1    . DC  B 2 3 ? -21.989 1.044   -9.776  1.00 26.25 ? 3   DC  B N1    1 
ATOM   249 C C2    . DC  B 2 3 ? -22.448 1.969   -8.830  1.00 23.77 ? 3   DC  B C2    1 
ATOM   250 O O2    . DC  B 2 3 ? -22.018 3.134   -8.864  1.00 26.88 ? 3   DC  B O2    1 
ATOM   251 N N3    . DC  B 2 3 ? -23.355 1.574   -7.915  1.00 25.70 ? 3   DC  B N3    1 
ATOM   252 C C4    . DC  B 2 3 ? -23.796 0.310   -7.903  1.00 24.49 ? 3   DC  B C4    1 
ATOM   253 N N4    . DC  B 2 3 ? -24.686 -0.030  -6.968  1.00 27.01 ? 3   DC  B N4    1 
ATOM   254 C C5    . DC  B 2 3 ? -23.337 -0.655  -8.853  1.00 25.64 ? 3   DC  B C5    1 
ATOM   255 C C6    . DC  B 2 3 ? -22.440 -0.249  -9.760  1.00 24.33 ? 3   DC  B C6    1 
ATOM   256 P P     . DT  B 2 4 ? -16.662 0.032   -9.370  1.00 30.27 ? 4   DT  B P     1 
ATOM   257 O OP1   . DT  B 2 4 ? -15.260 0.148   -9.826  1.00 34.58 ? 4   DT  B OP1   1 
ATOM   258 O OP2   . DT  B 2 4 ? -17.121 -1.207  -8.714  1.00 28.92 ? 4   DT  B OP2   1 
ATOM   259 O "O5'" . DT  B 2 4 ? -16.993 1.252   -8.399  1.00 29.78 ? 4   DT  B "O5'" 1 
ATOM   260 C "C5'" . DT  B 2 4 ? -16.570 2.551   -8.733  1.00 26.87 ? 4   DT  B "C5'" 1 
ATOM   261 C "C4'" . DT  B 2 4 ? -16.881 3.521   -7.616  1.00 27.15 ? 4   DT  B "C4'" 1 
ATOM   262 O "O4'" . DT  B 2 4 ? -18.315 3.721   -7.519  1.00 25.38 ? 4   DT  B "O4'" 1 
ATOM   263 C "C3'" . DT  B 2 4 ? -16.485 3.053   -6.232  1.00 24.69 ? 4   DT  B "C3'" 1 
ATOM   264 O "O3'" . DT  B 2 4 ? -15.116 3.295   -6.014  1.00 26.14 ? 4   DT  B "O3'" 1 
ATOM   265 C "C2'" . DT  B 2 4 ? -17.357 3.948   -5.365  1.00 23.81 ? 4   DT  B "C2'" 1 
ATOM   266 C "C1'" . DT  B 2 4 ? -18.663 3.943   -6.159  1.00 25.42 ? 4   DT  B "C1'" 1 
ATOM   267 N N1    . DT  B 2 4 ? -19.617 2.877   -5.725  1.00 23.58 ? 4   DT  B N1    1 
ATOM   268 C C2    . DT  B 2 4 ? -20.462 3.134   -4.684  1.00 21.72 ? 4   DT  B C2    1 
ATOM   269 O O2    . DT  B 2 4 ? -20.481 4.193   -4.097  1.00 24.77 ? 4   DT  B O2    1 
ATOM   270 N N3    . DT  B 2 4 ? -21.301 2.107   -4.357  1.00 24.63 ? 4   DT  B N3    1 
ATOM   271 C C4    . DT  B 2 4 ? -21.367 0.863   -4.951  1.00 24.32 ? 4   DT  B C4    1 
ATOM   272 O O4    . DT  B 2 4 ? -22.153 0.005   -4.580  1.00 27.19 ? 4   DT  B O4    1 
ATOM   273 C C5    . DT  B 2 4 ? -20.439 0.646   -6.033  1.00 25.45 ? 4   DT  B C5    1 
ATOM   274 C C7    . DT  B 2 4 ? -20.411 -0.670  -6.752  1.00 26.54 ? 4   DT  B C7    1 
ATOM   275 C C6    . DT  B 2 4 ? -19.618 1.655   -6.368  1.00 23.88 ? 4   DT  B C6    1 
ATOM   276 P P     . DT  B 2 5 ? -14.324 2.500   -4.873  1.00 24.81 ? 5   DT  B P     1 
ATOM   277 O OP1   . DT  B 2 5 ? -12.898 2.878   -5.032  1.00 26.38 ? 5   DT  B OP1   1 
ATOM   278 O OP2   . DT  B 2 5 ? -14.763 1.085   -4.905  1.00 22.80 ? 5   DT  B OP2   1 
ATOM   279 O "O5'" . DT  B 2 5 ? -14.847 3.155   -3.517  1.00 21.81 ? 5   DT  B "O5'" 1 
ATOM   280 C "C5'" . DT  B 2 5 ? -14.509 4.491   -3.219  1.00 22.63 ? 5   DT  B "C5'" 1 
ATOM   281 C "C4'" . DT  B 2 5 ? -15.325 5.010   -2.054  1.00 21.22 ? 5   DT  B "C4'" 1 
ATOM   282 O "O4'" . DT  B 2 5 ? -16.737 4.918   -2.363  1.00 23.00 ? 5   DT  B "O4'" 1 
ATOM   283 C "C3'" . DT  B 2 5 ? -15.195 4.224   -0.771  1.00 22.56 ? 5   DT  B "C3'" 1 
ATOM   284 O "O3'" . DT  B 2 5 ? -14.024 4.574   -0.089  1.00 23.77 ? 5   DT  B "O3'" 1 
ATOM   285 C "C2'" . DT  B 2 5 ? -16.429 4.698   -0.029  1.00 23.80 ? 5   DT  B "C2'" 1 
ATOM   286 C "C1'" . DT  B 2 5 ? -17.451 4.711   -1.157  1.00 20.56 ? 5   DT  B "C1'" 1 
ATOM   287 N N1    . DT  B 2 5 ? -18.228 3.441   -1.259  1.00 20.27 ? 5   DT  B N1    1 
ATOM   288 C C2    . DT  B 2 5 ? -19.313 3.286   -0.453  1.00 20.18 ? 5   DT  B C2    1 
ATOM   289 O O2    . DT  B 2 5 ? -19.657 4.128   0.346   1.00 22.35 ? 5   DT  B O2    1 
ATOM   290 N N3    . DT  B 2 5 ? -19.983 2.105   -0.605  1.00 20.23 ? 5   DT  B N3    1 
ATOM   291 C C4    . DT  B 2 5 ? -19.679 1.087   -1.476  1.00 20.49 ? 5   DT  B C4    1 
ATOM   292 O O4    . DT  B 2 5 ? -20.349 0.060   -1.545  1.00 20.96 ? 5   DT  B O4    1 
ATOM   293 C C5    . DT  B 2 5 ? -18.520 1.306   -2.297  1.00 20.30 ? 5   DT  B C5    1 
ATOM   294 C C7    . DT  B 2 5 ? -18.097 0.266   -3.288  1.00 22.63 ? 5   DT  B C7    1 
ATOM   295 C C6    . DT  B 2 5 ? -17.854 2.462   -2.157  1.00 20.45 ? 5   DT  B C6    1 
ATOM   296 P P     . DC  B 2 6 ? -13.396 3.564   0.982   1.00 22.43 ? 6   DC  B P     1 
ATOM   297 O OP1   . DC  B 2 6 ? -12.056 4.077   1.349   1.00 26.27 ? 6   DC  B OP1   1 
ATOM   298 O OP2   . DC  B 2 6 ? -13.566 2.168   0.516   1.00 25.28 ? 6   DC  B OP2   1 
ATOM   299 O "O5'" . DC  B 2 6 ? -14.332 3.689   2.266   1.00 21.29 ? 6   DC  B "O5'" 1 
ATOM   300 C "C5'" . DC  B 2 6 ? -14.297 4.859   3.060   1.00 20.15 ? 6   DC  B "C5'" 1 
ATOM   301 C "C4'" . DC  B 2 6 ? -15.305 4.778   4.182   1.00 20.33 ? 6   DC  B "C4'" 1 
ATOM   302 O "O4'" . DC  B 2 6 ? -16.634 4.647   3.625   1.00 22.00 ? 6   DC  B "O4'" 1 
ATOM   303 C "C3'" . DC  B 2 6 ? -15.147 3.569   5.075   1.00 21.45 ? 6   DC  B "C3'" 1 
ATOM   304 O "O3'" . DC  B 2 6 ? -14.194 3.844   6.072   1.00 23.50 ? 6   DC  B "O3'" 1 
ATOM   305 C "C2'" . DC  B 2 6 ? -16.544 3.435   5.663   1.00 19.96 ? 6   DC  B "C2'" 1 
ATOM   306 C "C1'" . DC  B 2 6 ? -17.416 3.805   4.464   1.00 21.16 ? 6   DC  B "C1'" 1 
ATOM   307 N N1    . DC  B 2 6 ? -17.852 2.622   3.676   1.00 19.85 ? 6   DC  B N1    1 
ATOM   308 C C2    . DC  B 2 6 ? -18.909 1.834   4.151   1.00 18.81 ? 6   DC  B C2    1 
ATOM   309 O O2    . DC  B 2 6 ? -19.470 2.153   5.208   1.00 21.81 ? 6   DC  B O2    1 
ATOM   310 N N3    . DC  B 2 6 ? -19.294 0.753   3.430   1.00 18.25 ? 6   DC  B N3    1 
ATOM   311 C C4    . DC  B 2 6 ? -18.665 0.445   2.287   1.00 18.71 ? 6   DC  B C4    1 
ATOM   312 N N4    . DC  B 2 6 ? -19.084 -0.634  1.611   1.00 20.25 ? 6   DC  B N4    1 
ATOM   313 C C5    . DC  B 2 6 ? -17.578 1.231   1.795   1.00 22.73 ? 6   DC  B C5    1 
ATOM   314 C C6    . DC  B 2 6 ? -17.208 2.296   2.518   1.00 19.07 ? 6   DC  B C6    1 
ATOM   315 P P     . DT  B 2 7 ? -13.167 2.708   6.537   1.00 23.54 ? 7   DT  B P     1 
ATOM   316 O OP1   . DT  B 2 7 ? -12.296 3.326   7.563   1.00 27.95 ? 7   DT  B OP1   1 
ATOM   317 O OP2   . DT  B 2 7 ? -12.590 2.058   5.357   1.00 24.36 ? 7   DT  B OP2   1 
ATOM   318 O "O5'" . DT  B 2 7 ? -14.101 1.649   7.267   1.00 23.24 ? 7   DT  B "O5'" 1 
ATOM   319 C "C5'" . DT  B 2 7 ? -14.670 1.966   8.526   1.00 23.44 ? 7   DT  B "C5'" 1 
ATOM   320 C "C4'" . DT  B 2 7 ? -15.758 0.980   8.878   1.00 21.85 ? 7   DT  B "C4'" 1 
ATOM   321 O "O4'" . DT  B 2 7 ? -16.732 0.956   7.817   1.00 20.19 ? 7   DT  B "O4'" 1 
ATOM   322 C "C3'" . DT  B 2 7 ? -15.307 -0.462  9.015   1.00 21.29 ? 7   DT  B "C3'" 1 
ATOM   323 O "O3'" . DT  B 2 7 ? -14.810 -0.694  10.319  1.00 22.32 ? 7   DT  B "O3'" 1 
ATOM   324 C "C2'" . DT  B 2 7 ? -16.615 -1.204  8.793   1.00 21.01 ? 7   DT  B "C2'" 1 
ATOM   325 C "C1'" . DT  B 2 7 ? -17.287 -0.342  7.727   1.00 20.70 ? 7   DT  B "C1'" 1 
ATOM   326 N N1    . DT  B 2 7 ? -17.100 -0.870  6.358   1.00 20.52 ? 7   DT  B N1    1 
ATOM   327 C C2    . DT  B 2 7 ? -17.915 -1.885  5.963   1.00 18.27 ? 7   DT  B C2    1 
ATOM   328 O O2    . DT  B 2 7 ? -18.775 -2.346  6.682   1.00 18.48 ? 7   DT  B O2    1 
ATOM   329 N N3    . DT  B 2 7 ? -17.702 -2.343  4.697   1.00 17.60 ? 7   DT  B N3    1 
ATOM   330 C C4    . DT  B 2 7 ? -16.745 -1.906  3.807   1.00 20.30 ? 7   DT  B C4    1 
ATOM   331 O O4    . DT  B 2 7 ? -16.627 -2.392  2.685   1.00 20.18 ? 7   DT  B O4    1 
ATOM   332 C C5    . DT  B 2 7 ? -15.891 -0.847  4.289   1.00 19.41 ? 7   DT  B C5    1 
ATOM   333 C C7    . DT  B 2 7 ? -14.819 -0.291  3.405   1.00 21.42 ? 7   DT  B C7    1 
ATOM   334 C C6    . DT  B 2 7 ? -16.101 -0.382  5.535   1.00 20.38 ? 7   DT  B C6    1 
ATOM   335 P P     . DT  B 2 8 ? -13.752 -1.879  10.585  1.00 23.54 ? 8   DT  B P     1 
ATOM   336 O OP1   . DT  B 2 8 ? -13.227 -1.667  11.956  1.00 25.85 ? 8   DT  B OP1   1 
ATOM   337 O OP2   . DT  B 2 8 ? -12.820 -1.961  9.438   1.00 22.96 ? 8   DT  B OP2   1 
ATOM   338 O "O5'" . DT  B 2 8 ? -14.639 -3.201  10.592  1.00 22.93 ? 8   DT  B "O5'" 1 
ATOM   339 C "C5'" . DT  B 2 8 ? -15.517 -3.468  11.677  1.00 21.49 ? 8   DT  B "C5'" 1 
ATOM   340 C "C4'" . DT  B 2 8 ? -16.463 -4.590  11.309  1.00 17.78 ? 8   DT  B "C4'" 1 
ATOM   341 O "O4'" . DT  B 2 8 ? -17.086 -4.269  10.049  1.00 19.86 ? 8   DT  B "O4'" 1 
ATOM   342 C "C3'" . DT  B 2 8 ? -15.799 -5.928  11.064  1.00 19.22 ? 8   DT  B "C3'" 1 
ATOM   343 O "O3'" . DT  B 2 8 ? -15.688 -6.625  12.277  1.00 20.68 ? 8   DT  B "O3'" 1 
ATOM   344 C "C2'" . DT  B 2 8 ? -16.784 -6.616  10.134  1.00 18.97 ? 8   DT  B "C2'" 1 
ATOM   345 C "C1'" . DT  B 2 8 ? -17.312 -5.460  9.316   1.00 18.80 ? 8   DT  B "C1'" 1 
ATOM   346 N N1    . DT  B 2 8 ? -16.684 -5.334  7.983   1.00 17.36 ? 8   DT  B N1    1 
ATOM   347 C C2    . DT  B 2 8 ? -17.154 -6.124  6.987   1.00 19.89 ? 8   DT  B C2    1 
ATOM   348 O O2    . DT  B 2 8 ? -18.024 -6.941  7.163   1.00 19.26 ? 8   DT  B O2    1 
ATOM   349 N N3    . DT  B 2 8 ? -16.565 -5.946  5.776   1.00 18.21 ? 8   DT  B N3    1 
ATOM   350 C C4    . DT  B 2 8 ? -15.566 -5.055  5.460   1.00 20.48 ? 8   DT  B C4    1 
ATOM   351 O O4    . DT  B 2 8 ? -15.115 -4.961  4.322   1.00 20.66 ? 8   DT  B O4    1 
ATOM   352 C C5    . DT  B 2 8 ? -15.103 -4.234  6.558   1.00 17.97 ? 8   DT  B C5    1 
ATOM   353 C C7    . DT  B 2 8 ? -14.012 -3.230  6.336   1.00 23.46 ? 8   DT  B C7    1 
ATOM   354 C C6    . DT  B 2 8 ? -15.679 -4.410  7.761   1.00 20.75 ? 8   DT  B C6    1 
HETATM 355 N N1    . 5CM B 2 9 ? -15.933 -10.041 7.753   1.00 21.18 ? 9   5CM B N1    1 
HETATM 356 C C2    . 5CM B 2 9 ? -15.975 -10.314 6.379   1.00 19.84 ? 9   5CM B C2    1 
HETATM 357 N N3    . 5CM B 2 9 ? -15.176 -9.564  5.518   1.00 20.43 ? 9   5CM B N3    1 
HETATM 358 C C4    . 5CM B 2 9 ? -14.421 -8.618  6.105   1.00 20.78 ? 9   5CM B C4    1 
HETATM 359 C C5    . 5CM B 2 9 ? -14.354 -8.318  7.481   1.00 20.35 ? 9   5CM B C5    1 
HETATM 360 C C5A   . 5CM B 2 9 ? -13.475 -7.254  7.998   1.00 20.82 ? 9   5CM B C5A   1 
HETATM 361 C C6    . 5CM B 2 9 ? -15.155 -9.054  8.309   1.00 18.11 ? 9   5CM B C6    1 
HETATM 362 O O2    . 5CM B 2 9 ? -16.704 -11.218 5.965   1.00 20.98 ? 9   5CM B O2    1 
HETATM 363 N N4    . 5CM B 2 9 ? -13.635 -7.885  5.205   1.00 21.18 ? 9   5CM B N4    1 
HETATM 364 C "C1'" . 5CM B 2 9 ? -16.821 -10.813 8.660   1.00 19.86 ? 9   5CM B "C1'" 1 
HETATM 365 C "C2'" . 5CM B 2 9 ? -16.079 -12.058 9.165   1.00 22.82 ? 9   5CM B "C2'" 1 
HETATM 366 C "C3'" . 5CM B 2 9 ? -15.749 -11.693 10.594  1.00 20.43 ? 9   5CM B "C3'" 1 
HETATM 367 C "C4'" . 5CM B 2 9 ? -16.885 -10.704 10.942  1.00 21.87 ? 9   5CM B "C4'" 1 
HETATM 368 O "O4'" . 5CM B 2 9 ? -17.127 -9.998  9.745   1.00 18.94 ? 9   5CM B "O4'" 1 
HETATM 369 O "O3'" . 5CM B 2 9 ? -15.742 -12.874 11.338  1.00 22.52 ? 9   5CM B "O3'" 1 
HETATM 370 C "C5'" . 5CM B 2 9 ? -16.381 -9.714  12.035  1.00 20.17 ? 9   5CM B "C5'" 1 
HETATM 371 O "O5'" . 5CM B 2 9 ? -15.289 -9.140  11.493  1.00 21.20 ? 9   5CM B "O5'" 1 
HETATM 372 P P     . 5CM B 2 9 ? -14.619 -7.811  12.391  1.00 21.21 ? 9   5CM B P     1 
HETATM 373 O OP1   . 5CM B 2 9 ? -14.590 -8.368  13.813  1.00 23.33 ? 9   5CM B OP1   1 
HETATM 374 O OP2   . 5CM B 2 9 ? -13.304 -7.471  11.714  1.00 22.31 ? 9   5CM B OP2   1 
HETATM 375 N N1    . SPM C 3 . ? -33.339 1.609   -7.958  1.00 34.88 ? 101 SPM A N1    1 
HETATM 376 C C2    . SPM C 3 . ? -33.354 2.941   -7.364  1.00 36.61 ? 101 SPM A C2    1 
HETATM 377 C C3    . SPM C 3 . ? -32.347 3.843   -8.067  1.00 31.97 ? 101 SPM A C3    1 
HETATM 378 C C4    . SPM C 3 . ? -31.226 4.262   -7.124  1.00 35.04 ? 101 SPM A C4    1 
HETATM 379 N N5    . SPM C 3 . ? -30.361 5.293   -7.686  1.00 26.99 ? 101 SPM A N5    1 
HETATM 380 C C6    . SPM C 3 . ? -31.060 6.553   -7.577  1.00 25.99 ? 101 SPM A C6    1 
HETATM 381 C C7    . SPM C 3 . ? -30.120 7.742   -7.367  1.00 25.99 ? 101 SPM A C7    1 
HETATM 382 C C8    . SPM C 3 . ? -30.982 8.952   -7.023  1.00 27.34 ? 101 SPM A C8    1 
HETATM 383 C C9    . SPM C 3 . ? -30.138 10.213  -6.893  1.00 25.57 ? 101 SPM A C9    1 
HETATM 384 N N10   . SPM C 3 . ? -31.030 11.352  -6.766  1.00 32.32 ? 101 SPM A N10   1 
HETATM 385 C C11   . SPM C 3 . ? -30.400 12.420  -6.014  1.00 30.84 ? 101 SPM A C11   1 
HETATM 386 C C12   . SPM C 3 . ? -29.548 13.280  -6.944  1.00 27.60 ? 101 SPM A C12   1 
HETATM 387 C C13   . SPM C 3 . ? -30.435 13.902  -8.020  1.00 29.89 ? 101 SPM A C13   1 
HETATM 388 N N14   . SPM C 3 . ? -29.615 14.508  -9.054  1.00 32.00 ? 101 SPM A N14   1 
HETATM 389 O O     . HOH D 4 . ? -27.081 -3.770  3.628   1.00 34.57 ? 201 HOH A O     1 
HETATM 390 O O     . HOH D 4 . ? -27.599 0.465   -4.355  1.00 36.05 ? 202 HOH A O     1 
HETATM 391 O O     . HOH D 4 . ? -19.832 -8.225  -3.360  1.00 35.95 ? 203 HOH A O     1 
HETATM 392 O O     . HOH D 4 . ? -22.868 9.402   -12.721 1.00 28.70 ? 204 HOH A O     1 
HETATM 393 O O     . HOH D 4 . ? -25.156 -10.394 7.378   1.00 36.13 ? 205 HOH A O     1 
HETATM 394 O O     . HOH D 4 . ? -12.555 -6.682  1.206   1.00 34.38 ? 206 HOH A O     1 
HETATM 395 O O     . HOH D 4 . ? -25.316 5.720   5.970   1.00 29.80 ? 207 HOH A O     1 
HETATM 396 O O     . HOH D 4 . ? -30.213 -6.397  4.962   1.00 36.54 ? 208 HOH A O     1 
HETATM 397 O O     . HOH D 4 . ? -26.792 -0.782  -0.250  1.00 37.70 ? 209 HOH A O     1 
HETATM 398 O O     . HOH D 4 . ? -22.446 6.767   -11.490 1.00 30.35 ? 210 HOH A O     1 
HETATM 399 O O     . HOH D 4 . ? -19.674 -12.016 4.531   1.00 26.02 ? 211 HOH A O     1 
HETATM 400 O O     . HOH D 4 . ? -19.283 -5.544  -0.697  1.00 32.34 ? 212 HOH A O     1 
HETATM 401 O O     . HOH D 4 . ? -23.028 4.390   4.900   1.00 33.28 ? 213 HOH A O     1 
HETATM 402 O O     . HOH D 4 . ? -22.004 -3.631  0.560   1.00 26.19 ? 214 HOH A O     1 
HETATM 403 O O     . HOH D 4 . ? -28.576 4.707   -5.663  1.00 30.30 ? 215 HOH A O     1 
HETATM 404 O O     . HOH D 4 . ? -23.949 -5.703  2.032   1.00 28.55 ? 216 HOH A O     1 
HETATM 405 O O     . HOH D 4 . ? -22.890 -12.146 -4.561  1.00 35.87 ? 217 HOH A O     1 
HETATM 406 O O     . HOH D 4 . ? -25.149 -3.123  0.695   1.00 33.12 ? 218 HOH A O     1 
HETATM 407 O O     . HOH D 4 . ? -27.814 -4.272  10.413  1.00 34.68 ? 219 HOH A O     1 
HETATM 408 O O     . HOH D 4 . ? -24.211 12.945  -11.161 1.00 32.13 ? 220 HOH A O     1 
HETATM 409 O O     . HOH D 4 . ? -29.428 17.029  -7.581  1.00 37.83 ? 221 HOH A O     1 
HETATM 410 O O     . HOH D 4 . ? -15.419 -5.597  -0.545  1.00 34.94 ? 222 HOH A O     1 
HETATM 411 O O     . HOH D 4 . ? -31.069 1.418   -5.984  1.00 39.33 ? 223 HOH A O     1 
HETATM 412 O O     A HOH D 4 . ? -17.404 -14.674 1.257   0.44 26.35 ? 224 HOH A O     1 
HETATM 413 O O     B HOH D 4 . ? -18.433 -14.736 1.972   0.56 25.50 ? 224 HOH A O     1 
HETATM 414 O O     . HOH D 4 . ? -30.352 -3.620  9.956   1.00 38.61 ? 225 HOH A O     1 
HETATM 415 O O     . HOH D 4 . ? -23.852 -6.815  -0.500  1.00 33.33 ? 226 HOH A O     1 
HETATM 416 O O     . HOH D 4 . ? -22.137 6.811   0.594   1.00 36.57 ? 227 HOH A O     1 
HETATM 417 O O     . HOH D 4 . ? -23.774 12.488  -2.957  1.00 35.88 ? 228 HOH A O     1 
HETATM 418 O O     . HOH D 4 . ? -24.924 14.129  -4.429  1.00 36.23 ? 229 HOH A O     1 
HETATM 419 O O     . HOH D 4 . ? -28.817 13.331  -14.090 1.00 36.64 ? 230 HOH A O     1 
HETATM 420 O O     . HOH D 4 . ? -30.531 12.274  -1.593  1.00 40.15 ? 231 HOH A O     1 
HETATM 421 O O     . HOH E 4 . ? -27.983 -6.421  -9.049  1.00 35.88 ? 101 HOH B O     1 
HETATM 422 O O     . HOH E 4 . ? -10.781 2.386   9.320   1.00 37.56 ? 102 HOH B O     1 
HETATM 423 O O     . HOH E 4 . ? -11.429 -5.757  11.441  1.00 36.13 ? 103 HOH B O     1 
HETATM 424 O O     . HOH E 4 . ? -17.632 -5.085  -11.722 1.00 43.77 ? 104 HOH B O     1 
HETATM 425 O O     . HOH E 4 . ? -13.574 -7.239  15.882  1.00 36.02 ? 105 HOH B O     1 
HETATM 426 O O     . HOH E 4 . ? -20.474 -2.345  -2.453  1.00 32.35 ? 106 HOH B O     1 
HETATM 427 O O     . HOH E 4 . ? -15.138 0.449   -0.691  1.00 26.45 ? 107 HOH B O     1 
HETATM 428 O O     . HOH E 4 . ? -28.645 -0.245  -6.740  1.00 27.66 ? 108 HOH B O     1 
HETATM 429 O O     . HOH E 4 . ? -14.079 -0.547  -2.916  1.00 32.95 ? 109 HOH B O     1 
HETATM 430 O O     . HOH E 4 . ? -14.938 -12.668 13.880  1.00 26.45 ? 110 HOH B O     1 
HETATM 431 O O     . HOH E 4 . ? -14.799 -15.159 10.304  1.00 28.57 ? 111 HOH B O     1 
HETATM 432 O O     . HOH E 4 . ? -11.905 -3.371  13.565  1.00 38.28 ? 112 HOH B O     1 
HETATM 433 O O     . HOH E 4 . ? -13.647 -10.566 15.058  1.00 25.88 ? 113 HOH B O     1 
HETATM 434 O O     . HOH E 4 . ? -10.859 3.317   3.649   1.00 36.45 ? 114 HOH B O     1 
HETATM 435 O O     . HOH E 4 . ? -20.181 -4.654  -15.442 1.00 37.31 ? 115 HOH B O     1 
HETATM 436 O O     A HOH E 4 . ? -22.780 -2.613  -5.060  0.54 28.29 ? 116 HOH B O     1 
HETATM 437 O O     B HOH E 4 . ? -21.662 -4.319  -6.037  0.46 29.46 ? 116 HOH B O     1 
HETATM 438 O O     . HOH E 4 . ? -10.882 -0.594  8.051   1.00 33.67 ? 117 HOH B O     1 
HETATM 439 O O     . HOH E 4 . ? -16.496 -0.799  -5.905  1.00 30.66 ? 118 HOH B O     1 
HETATM 440 O O     . HOH E 4 . ? -12.776 -4.207  3.042   1.00 33.00 ? 119 HOH B O     1 
HETATM 441 O O     . HOH E 4 . ? -17.965 -3.846  -8.925  1.00 37.79 ? 120 HOH B O     1 
HETATM 442 O O     . HOH E 4 . ? -11.199 -0.366  5.456   1.00 35.34 ? 121 HOH B O     1 
HETATM 443 O O     . HOH E 4 . ? -22.242 -7.001  -11.123 1.00 37.69 ? 122 HOH B O     1 
HETATM 444 O O     . HOH E 4 . ? -13.481 5.399   9.046   1.00 35.61 ? 123 HOH B O     1 
HETATM 445 O O     . HOH E 4 . ? -11.753 0.070   0.987   1.00 34.80 ? 124 HOH B O     1 
HETATM 446 O O     . HOH E 4 . ? -21.371 6.811   -3.570  1.00 32.58 ? 125 HOH B O     1 
HETATM 447 O O     . HOH E 4 . ? -11.451 -4.288  8.638   1.00 34.23 ? 126 HOH B O     1 
HETATM 448 O O     . HOH E 4 . ? -24.522 -9.331  -11.120 1.00 37.22 ? 127 HOH B O     1 
HETATM 449 O O     . HOH E 4 . ? -17.718 -13.898 5.958   1.00 29.27 ? 128 HOH B O     1 
HETATM 450 O O     . HOH E 4 . ? -16.852 -1.546  -0.049  1.00 27.02 ? 129 HOH B O     1 
HETATM 451 O O     . HOH E 4 . ? -20.759 4.558   6.120   1.00 27.60 ? 130 HOH B O     1 
HETATM 452 O O     . HOH E 4 . ? -20.837 -4.020  -8.336  1.00 39.73 ? 131 HOH B O     1 
HETATM 453 O O     . HOH E 4 . ? -11.453 -5.957  5.386   1.00 30.23 ? 132 HOH B O     1 
HETATM 454 O O     . HOH E 4 . ? -24.274 -4.124  -9.371  1.00 28.76 ? 133 HOH B O     1 
HETATM 455 O O     . HOH E 4 . ? -25.283 -2.985  -6.849  1.00 33.72 ? 134 HOH B O     1 
HETATM 456 O O     . HOH E 4 . ? -34.054 -4.488  -11.471 1.00 34.47 ? 135 HOH B O     1 
HETATM 457 O O     . HOH E 4 . ? -30.042 -4.907  -8.578  1.00 35.34 ? 136 HOH B O     1 
HETATM 458 O O     . HOH E 4 . ? -17.873 -3.202  -4.516  1.00 35.69 ? 137 HOH B O     1 
HETATM 459 O O     . HOH E 4 . ? -11.229 -2.197  3.627   1.00 38.32 ? 138 HOH B O     1 
# 
