data_A1ARI
# 
_chem_comp.id                                    A1ARI 
_chem_comp.name                                  "O-tert-butyl-N-{[(propan-2-yl)oxy]carbonyl}-L-threonyl-3-cyclohexyl-N-{(2R)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-L-alaninamide" 
_chem_comp.type                                  non-polymer 
_chem_comp.pdbx_type                             HETAIN 
_chem_comp.formula                               "C28 H50 N4 O7" 
_chem_comp.mon_nstd_parent_comp_id               ? 
_chem_comp.pdbx_synonyms                         ? 
_chem_comp.pdbx_formal_charge                    0 
_chem_comp.pdbx_initial_date                     2024-05-13 
_chem_comp.pdbx_modified_date                    2025-05-09 
_chem_comp.pdbx_ambiguous_flag                   N 
_chem_comp.pdbx_release_status                   REL 
_chem_comp.pdbx_replaced_by                      ? 
_chem_comp.pdbx_replaces                         ? 
_chem_comp.formula_weight                        554.719 
_chem_comp.one_letter_code                       ? 
_chem_comp.three_letter_code                     A1ARI 
_chem_comp.pdbx_model_coordinates_details        ? 
_chem_comp.pdbx_model_coordinates_missing_flag   N 
_chem_comp.pdbx_ideal_coordinates_details        Corina 
_chem_comp.pdbx_ideal_coordinates_missing_flag   N 
_chem_comp.pdbx_model_coordinates_db_code        9BQM 
_chem_comp.pdbx_subcomponent_list                ? 
_chem_comp.pdbx_processing_site                  RCSB 
_chem_comp.pdbx_pcm                              Y 
# 
loop_
_chem_comp_atom.comp_id 
_chem_comp_atom.atom_id 
_chem_comp_atom.alt_atom_id 
_chem_comp_atom.type_symbol 
_chem_comp_atom.charge 
_chem_comp_atom.pdbx_align 
_chem_comp_atom.pdbx_aromatic_flag 
_chem_comp_atom.pdbx_leaving_atom_flag 
_chem_comp_atom.pdbx_stereo_config 
_chem_comp_atom.pdbx_n_terminal_atom_flag 
_chem_comp_atom.pdbx_backbone_atom_flag 
_chem_comp_atom.pdbx_c_terminal_atom_flag 
_chem_comp_atom.model_Cartn_x 
_chem_comp_atom.model_Cartn_y 
_chem_comp_atom.model_Cartn_z 
_chem_comp_atom.pdbx_model_Cartn_x_ideal 
_chem_comp_atom.pdbx_model_Cartn_y_ideal 
_chem_comp_atom.pdbx_model_Cartn_z_ideal 
_chem_comp_atom.pdbx_component_atom_id 
_chem_comp_atom.pdbx_component_comp_id 
_chem_comp_atom.pdbx_ordinal 
A1ARI N    N1  N 0 1 N N N N N N -9.799  -15.290 -18.182 -0.650 0.433  1.041  N    A1ARI 1  
A1ARI C    C1  C 0 1 N N S N N N -10.147 -17.647 -18.340 -3.084 0.182  0.676  C    A1ARI 2  
A1ARI O    O1  O 0 1 N N N N N N -10.836 -16.305 -16.466 -1.566 1.157  -0.846 O    A1ARI 3  
A1ARI C1   C2  C 0 1 N N N N N N -10.296 -16.361 -17.577 -1.713 0.626  0.235  C1   A1ARI 4  
A1ARI C10  C3  C 0 1 N N N N N N -14.982 -15.678 -14.970 3.351  -1.496 -1.478 C10  A1ARI 5  
A1ARI C11  C4  C 0 1 N N N N N N -9.098  -12.979 -18.355 0.972  2.251  0.836  C11  A1ARI 6  
A1ARI C12  C5  C 0 1 N N N N N N -7.749  -12.596 -17.734 2.368  2.609  0.320  C12  A1ARI 7  
A1ARI C13  C6  C 0 1 N N R N N N -11.526 -18.230 -18.672 -3.076 -1.329 0.922  C13  A1ARI 8  
A1ARI C14  C7  C 0 1 N N N N N N -12.439 -17.163 -19.289 -4.495 -1.799 1.249  C14  A1ARI 9  
A1ARI C15  C8  C 0 1 N N N N N N -8.066  -18.839 -17.771 -5.358 0.677  -0.046 C15  A1ARI 10 
A1ARI C16  C9  C 0 1 N N N N N N -6.163  -20.239 -17.162 -7.634 1.147  -0.587 C16  A1ARI 11 
A1ARI C17  C10 C 0 1 N N N N N N -12.037 -20.554 -19.293 -1.803 -3.148 0.020  C17  A1ARI 12 
A1ARI C18  C11 C 0 1 N N N N N N -11.175 -21.281 -18.266 -2.571 -4.109 0.928  C18  A1ARI 13 
A1ARI C19  C12 C 0 1 N N N N N N -12.129 -21.374 -20.574 -0.511 -2.711 0.715  C19  A1ARI 14 
A1ARI C2   C13 C 0 1 N N S N N N -9.912  -13.994 -17.550 0.696  0.770  0.571  C2   A1ARI 15 
A1ARI C20  C14 C 0 1 N N N N N N -13.460 -20.405 -18.754 -1.461 -3.852 -1.295 C20  A1ARI 16 
A1ARI C21  C15 C 0 1 N N N N N N -6.715  -12.429 -18.848 2.704  4.048  0.718  C21  A1ARI 17 
A1ARI C22  C16 C 0 1 N N N N N N -5.307  -12.070 -18.372 4.100  4.406  0.203  C22  A1ARI 18 
A1ARI C23  C17 C 0 1 N N N N N N -5.041  -12.540 -16.950 4.129  4.279  -1.321 C23  A1ARI 19 
A1ARI C24  C18 C 0 1 N N N N N N -5.768  -13.848 -16.690 3.792  2.840  -1.719 C24  A1ARI 20 
A1ARI C25  C19 C 0 1 N N N N N N -7.283  -13.647 -16.724 2.397  2.482  -1.204 C25  A1ARI 21 
A1ARI C26  C20 C 0 1 N N N N N N -6.373  -21.684 -17.588 -7.877 2.616  -0.235 C26  A1ARI 22 
A1ARI C27  C21 C 0 1 N N N N N N -5.250  -20.218 -15.950 -8.570 0.734  -1.725 C27  A1ARI 23 
A1ARI C3   C22 C 0 1 N N N N N N -11.360 -13.602 -17.470 1.709  -0.070 1.306  C3   A1ARI 24 
A1ARI C4   C23 C 0 1 N N S N N N -13.163 -12.568 -16.397 3.904  -1.117 1.456  C4   A1ARI 25 
A1ARI C5   C24 C 0 1 N N N N N N -13.108 -11.069 -16.100 4.591  -0.411 2.627  C5   A1ARI 26 
A1ARI C6   C25 C 0 1 N N N N N N -14.054 -13.382 -15.457 4.957  -1.555 0.437  C6   A1ARI 27 
A1ARI C7   C26 C 0 1 N N S N N N -14.157 -14.846 -15.906 4.286  -2.369 -0.672 C7   A1ARI 28 
A1ARI C8   C27 C 0 1 N N N N N N -14.903 -14.998 -17.238 5.336  -2.851 -1.700 C8   A1ARI 29 
A1ARI C9   C28 C 0 1 N N N N N N -15.788 -16.232 -17.065 5.269  -1.733 -2.765 C9   A1ARI 30 
A1ARI N1   N2  N 0 1 N N N N N N -11.808 -13.069 -16.343 2.959  -0.197 0.818  N1   A1ARI 31 
A1ARI N2   N3  N 0 1 N N N N N N -15.853 -16.428 -15.634 3.924  -1.159 -2.646 N2   A1ARI 32 
A1ARI N3   N4  N 0 1 N N N N N N -9.355  -18.567 -17.550 -4.061 0.501  -0.368 N3   A1ARI 33 
A1ARI O1   O2  O 0 1 N N N N N N -12.120 -13.779 -18.408 1.400  -0.630 2.336  O1   A1ARI 34 
A1ARI O2   O3  O 0 1 N N N N N N -14.405 -10.472 -16.003 5.388  0.667  2.132  O2   A1ARI 35 
A1ARI O3   O4  O 0 1 N N N N N N -14.854 -15.656 -13.755 2.243  -1.153 -1.123 O3   A1ARI 36 
A1ARI O4   O5  O 0 1 N N N N N N -11.409 -19.301 -19.613 -2.610 -2.000 -0.250 O4   A1ARI 37 
A1ARI O5   O6  O 0 1 N N N N N N -7.398  -19.647 -16.766 -6.255 0.971  -1.006 O5   A1ARI 38 
A1ARI O6   O7  O 0 1 N N N N N N -7.430  -18.450 -18.737 -5.717 0.571  1.110  O6   A1ARI 39 
A1ARI HN   H1  H 0 1 N N N N N N -9.349  -15.378 -19.070 -0.777 0.074  1.933  HN   A1ARI 40 
A1ARI H0   H2  H 0 1 N N N N N N -9.626  -17.436 -19.285 -3.354 0.698  1.597  H0   A1ARI 41 
A1ARI H111 H3  H 0 0 N N N N N N -8.907  -13.406 -19.350 0.920  2.444  1.907  H111 A1ARI 42 
A1ARI H112 H4  H 0 0 N N N N N N -9.699  -12.064 -18.458 0.228  2.857  0.320  H112 A1ARI 43 
A1ARI H12  H5  H 0 1 N N N N N N -7.863  -11.634 -17.213 3.101  1.931  0.756  H12  A1ARI 44 
A1ARI H13  H6  H 0 1 N N N N N N -11.988 -18.593 -17.742 -2.416 -1.557 1.759  H13  A1ARI 45 
A1ARI H142 H7  H 0 0 N N N N N N -13.420 -17.606 -19.517 -5.134 -1.657 0.378  H142 A1ARI 46 
A1ARI H141 H8  H 0 0 N N N N N N -12.568 -16.335 -18.577 -4.474 -2.856 1.516  H141 A1ARI 47 
A1ARI H143 H9  H 0 0 N N N N N N -11.984 -16.783 -20.215 -4.886 -1.220 2.086  H143 A1ARI 48 
A1ARI H162 H10 H 0 0 N N N N N N -5.700  -19.674 -17.985 -7.830 0.527  0.288  H162 A1ARI 49 
A1ARI H182 H11 H 0 0 N N N N N N -11.642 -22.243 -18.010 -3.513 -4.384 0.453  H182 A1ARI 50 
A1ARI H183 H12 H 0 0 N N N N N N -10.175 -21.460 -18.688 -1.974 -5.006 1.096  H183 A1ARI 51 
A1ARI H181 H13 H 0 0 N N N N N N -11.086 -20.664 -17.360 -2.773 -3.624 1.883  H181 A1ARI 52 
A1ARI H191 H14 H 0 0 N N N N N N -12.607 -22.341 -20.358 -0.755 -2.210 1.652  H191 A1ARI 53 
A1ARI H192 H15 H 0 0 N N N N N N -12.728 -20.827 -21.317 0.104  -3.587 0.921  H192 A1ARI 54 
A1ARI H193 H16 H 0 0 N N N N N N -11.118 -21.546 -20.973 0.036  -2.026 0.068  H193 A1ARI 55 
A1ARI H2   H17 H 0 1 N N N N N N -9.500  -14.043 -16.531 0.768  0.572  -0.499 H2   A1ARI 56 
A1ARI H201 H18 H 0 0 N N N N N N -13.875 -21.399 -18.532 -0.914 -3.166 -1.942 H201 A1ARI 57 
A1ARI H203 H19 H 0 0 N N N N N N -13.442 -19.802 -17.834 -0.845 -4.727 -1.089 H203 A1ARI 58 
A1ARI H202 H20 H 0 0 N N N N N N -14.087 -19.906 -19.508 -2.381 -4.162 -1.790 H202 A1ARI 59 
A1ARI H212 H21 H 0 0 N N N N N N -6.656  -13.376 -19.404 1.971  4.727  0.283  H212 A1ARI 60 
A1ARI H211 H22 H 0 0 N N N N N N -7.063  -11.630 -19.520 2.684  4.139  1.804  H211 A1ARI 61 
A1ARI H221 H23 H 0 0 N N N N N N -4.575  -12.543 -19.044 4.339  5.431  0.486  H221 A1ARI 62 
A1ARI H222 H24 H 0 0 N N N N N N -5.188  -10.977 -18.411 4.833  3.728  0.638  H222 A1ARI 63 
A1ARI H231 H25 H 0 0 N N N N N N -3.960  -12.691 -16.812 3.395  4.957  -1.757 H231 A1ARI 64 
A1ARI H232 H26 H 0 0 N N N N N N -5.398  -11.778 -16.242 5.123  4.534  -1.689 H232 A1ARI 65 
A1ARI H241 H27 H 0 0 N N N N N N -5.484  -14.577 -17.463 3.813  2.749  -2.805 H241 A1ARI 66 
A1ARI H242 H28 H 0 0 N N N N N N -5.478  -14.231 -15.700 4.526  2.162  -1.284 H242 A1ARI 67 
A1ARI H251 H29 H 0 0 N N N N N N -7.613  -13.334 -15.722 2.157  1.457  -1.487 H251 A1ARI 68 
A1ARI H252 H30 H 0 0 N N N N N N -7.754  -14.607 -16.982 1.663  3.160  -1.640 H252 A1ARI 69 
A1ARI H26  H31 H 0 1 N N N N N N -5.410  -22.122 -17.889 -8.912 2.748  0.080  H26  A1ARI 70 
A1ARI H261 H32 H 0 0 N N N N N N -6.789  -22.257 -16.747 -7.210 2.910  0.576  H261 A1ARI 71 
A1ARI H262 H33 H 0 0 N N N N N N -7.072  -21.718 -18.436 -7.681 3.236  -1.110 H262 A1ARI 72 
A1ARI H271 H34 H 0 0 N N N N N N -4.281  -20.668 -16.212 -8.397 -0.313 -1.975 H271 A1ARI 73 
A1ARI H27  H35 H 0 1 N N N N N N -5.096  -19.178 -15.625 -9.605 0.866  -1.410 H27  A1ARI 74 
A1ARI H272 H36 H 0 0 N N N N N N -5.712  -20.792 -15.133 -8.374 1.354  -2.599 H272 A1ARI 75 
A1ARI H4   H37 H 0 1 N N N N N N -13.549 -12.694 -17.419 3.368  -1.992 1.824  H4   A1ARI 76 
A1ARI H5   H38 H 0 1 N N N N N N -12.581 -10.919 -15.146 3.835  -0.021 3.310  H5   A1ARI 77 
A1ARI H    H39 H 0 1 N N N N N N -12.552 -10.571 -16.908 5.227  -1.120 3.157  H    A1ARI 78 
A1ARI H61  H40 H 0 1 N N N N N N -15.061 -12.940 -15.447 5.433  -0.675 0.004  H61  A1ARI 79 
A1ARI H62  H41 H 0 1 N N N N N N -13.629 -13.348 -14.443 5.710  -2.168 0.933  H62  A1ARI 80 
A1ARI H7   H42 H 0 1 N N N N N N -13.148 -15.274 -15.999 3.747  -3.217 -0.248 H7   A1ARI 81 
A1ARI H82  H43 H 0 1 N N N N N N -14.191 -15.147 -18.064 6.328  -2.902 -1.251 H82  A1ARI 82 
A1ARI H81  H44 H 0 1 N N N N N N -15.517 -14.108 -17.439 5.052  -3.813 -2.126 H81  A1ARI 83 
A1ARI H92  H45 H 0 1 N N N N N N -15.338 -17.106 -17.558 6.023  -0.973 -2.561 H92  A1ARI 84 
A1ARI H91  H46 H 0 1 N N N N N N -16.791 -16.053 -17.480 5.416  -2.152 -3.761 H91  A1ARI 85 
A1ARI HN1  H47 H 0 1 N N N N N N -11.250 -13.017 -15.515 3.233  0.320  0.044  HN1  A1ARI 86 
A1ARI HN2  H48 H 0 1 N N N N N N -16.487 -17.062 -15.191 3.502  -0.608 -3.324 HN2  A1ARI 87 
A1ARI HN3  H49 H 0 1 N N N N N N -9.804  -19.031 -16.786 -3.774 0.586  -1.291 HN3  A1ARI 88 
A1ARI HO2  H50 H 0 1 N N N N N N -14.314 -9.545  -15.818 5.853  1.160  2.822  HO2  A1ARI 89 
# 
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 
A1ARI O3  C10  DOUB N N 1  
A1ARI C10 N2   SING N N 2  
A1ARI C10 C7   SING N N 3  
A1ARI N2  C9   SING N N 4  
A1ARI C9  C8   SING N N 5  
A1ARI C8  C7   SING N N 6  
A1ARI C7  C6   SING N N 7  
A1ARI C6  C4   SING N N 8  
A1ARI C5  C4   SING N N 9  
A1ARI C4  N1   SING N N 10 
A1ARI O2  C5   SING N N 11 
A1ARI N1  C3   SING N N 12 
A1ARI O1  C3   DOUB N N 13 
A1ARI C3  C2   SING N N 14 
A1ARI C11 C2   SING N N 15 
A1ARI C2  N    SING N N 16 
A1ARI C12 C11  SING N N 17 
A1ARI C12 C21  SING N N 18 
A1ARI C25 C12  SING N N 19 
A1ARI C21 C22  SING N N 20 
A1ARI C22 C23  SING N N 21 
A1ARI C23 C24  SING N N 22 
A1ARI C24 C25  SING N N 23 
A1ARI N   C1   SING N N 24 
A1ARI O   C1   DOUB N N 25 
A1ARI C1  C    SING N N 26 
A1ARI C13 C    SING N N 27 
A1ARI C   N3   SING N N 28 
A1ARI C14 C13  SING N N 29 
A1ARI O4  C13  SING N N 30 
A1ARI C17 O4   SING N N 31 
A1ARI C18 C17  SING N N 32 
A1ARI C19 C17  SING N N 33 
A1ARI C20 C17  SING N N 34 
A1ARI N3  C15  SING N N 35 
A1ARI C15 O6   DOUB N N 36 
A1ARI O5  C15  SING N N 37 
A1ARI C16 O5   SING N N 38 
A1ARI C26 C16  SING N N 39 
A1ARI C27 C16  SING N N 40 
A1ARI N   HN   SING N N 41 
A1ARI C   H0   SING N N 42 
A1ARI C11 H111 SING N N 43 
A1ARI C11 H112 SING N N 44 
A1ARI C12 H12  SING N N 45 
A1ARI C13 H13  SING N N 46 
A1ARI C14 H142 SING N N 47 
A1ARI C14 H141 SING N N 48 
A1ARI C14 H143 SING N N 49 
A1ARI C16 H162 SING N N 50 
A1ARI C18 H182 SING N N 51 
A1ARI C18 H183 SING N N 52 
A1ARI C18 H181 SING N N 53 
A1ARI C19 H191 SING N N 54 
A1ARI C19 H192 SING N N 55 
A1ARI C19 H193 SING N N 56 
A1ARI C2  H2   SING N N 57 
A1ARI C20 H201 SING N N 58 
A1ARI C20 H203 SING N N 59 
A1ARI C20 H202 SING N N 60 
A1ARI C21 H212 SING N N 61 
A1ARI C21 H211 SING N N 62 
A1ARI C22 H221 SING N N 63 
A1ARI C22 H222 SING N N 64 
A1ARI C23 H231 SING N N 65 
A1ARI C23 H232 SING N N 66 
A1ARI C24 H241 SING N N 67 
A1ARI C24 H242 SING N N 68 
A1ARI C25 H251 SING N N 69 
A1ARI C25 H252 SING N N 70 
A1ARI C26 H26  SING N N 71 
A1ARI C26 H261 SING N N 72 
A1ARI C26 H262 SING N N 73 
A1ARI C27 H271 SING N N 74 
A1ARI C27 H27  SING N N 75 
A1ARI C27 H272 SING N N 76 
A1ARI C4  H4   SING N N 77 
A1ARI C5  H5   SING N N 78 
A1ARI C5  H    SING N N 79 
A1ARI C6  H61  SING N N 80 
A1ARI C6  H62  SING N N 81 
A1ARI C7  H7   SING N N 82 
A1ARI C8  H82  SING N N 83 
A1ARI C8  H81  SING N N 84 
A1ARI C9  H92  SING N N 85 
A1ARI C9  H91  SING N N 86 
A1ARI N1  HN1  SING N N 87 
A1ARI N2  HN2  SING N N 88 
A1ARI N3  HN3  SING N N 89 
A1ARI O2  HO2  SING N N 90 
# 
loop_
_pdbx_chem_comp_descriptor.comp_id 
_pdbx_chem_comp_descriptor.type 
_pdbx_chem_comp_descriptor.program 
_pdbx_chem_comp_descriptor.program_version 
_pdbx_chem_comp_descriptor.descriptor 
A1ARI SMILES           ACDLabs              12.01 "CC(C)(C)OC(C)C(NC(=O)OC(C)C)C(=O)NC(CC1CCCCC1)C(=O)NC(CC1CCNC1=O)CO"                                                                                                                                                            
A1ARI InChI            InChI                1.06  "InChI=1S/C28H50N4O7/c1-17(2)38-27(37)32-23(18(3)39-28(4,5)6)26(36)31-22(14-19-10-8-7-9-11-19)25(35)30-21(16-33)15-20-12-13-29-24(20)34/h17-23,33H,7-16H2,1-6H3,(H,29,34)(H,30,35)(H,31,36)(H,32,37)/t18-,20+,21-,22+,23?/m1/s1" 
A1ARI InChIKey         InChI                1.06  UBWPCMLMIZPHFF-PDTZRLOFSA-N                                                                                                                                                                                                      
A1ARI SMILES_CANONICAL CACTVS               3.385 "CC(C)OC(=O)N[C@@H]([C@@H](C)OC(C)(C)C)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@H](CO)C[C@@H]2CCNC2=O"                                                                                                                                    
A1ARI SMILES           CACTVS               3.385 "CC(C)OC(=O)N[CH]([CH](C)OC(C)(C)C)C(=O)N[CH](CC1CCCCC1)C(=O)N[CH](CO)C[CH]2CCNC2=O"                                                                                                                                             
A1ARI SMILES_CANONICAL "OpenEye OEToolkits" 2.0.7 "C[C@H]([C@@H](C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](C[C@@H]2CCNC2=O)CO)NC(=O)OC(C)C)OC(C)(C)C"                                                                                                                                    
A1ARI SMILES           "OpenEye OEToolkits" 2.0.7 "CC(C)OC(=O)NC(C(C)OC(C)(C)C)C(=O)NC(CC1CCCCC1)C(=O)NC(CC2CCNC2=O)CO"                                                                                                                                                            
# 
loop_
_pdbx_chem_comp_identifier.comp_id 
_pdbx_chem_comp_identifier.type 
_pdbx_chem_comp_identifier.program 
_pdbx_chem_comp_identifier.program_version 
_pdbx_chem_comp_identifier.identifier 
A1ARI "SYSTEMATIC NAME" ACDLabs              12.01 "O-tert-butyl-N-{[(propan-2-yl)oxy]carbonyl}-L-threonyl-3-cyclohexyl-N-{(2R)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-L-alaninamide"                                                                                                    
A1ARI "SYSTEMATIC NAME" "OpenEye OEToolkits" 2.0.7 "propan-2-yl ~{N}-[(2~{S},3~{R})-1-[[(2~{S})-3-cyclohexyl-1-oxidanylidene-1-[[(2~{S})-1-oxidanyl-3-[(3~{S})-2-oxidanylidenepyrrolidin-3-yl]propan-2-yl]amino]propan-2-yl]amino]-3-[(2-methylpropan-2-yl)oxy]-1-oxidanylidene-butan-2-yl]carbamate" 
# 
loop_
_pdbx_chem_comp_audit.comp_id 
_pdbx_chem_comp_audit.action_type 
_pdbx_chem_comp_audit.date 
_pdbx_chem_comp_audit.processing_site 
A1ARI "Create component" 2024-05-13 RCSB 
A1ARI "Modify PCM"       2024-09-27 PDBE 
A1ARI "Initial release"  2025-05-14 RCSB 
# 
_pdbx_chem_comp_pcm.pcm_id                             1 
_pdbx_chem_comp_pcm.comp_id                            A1ARI 
_pdbx_chem_comp_pcm.modified_residue_id                CYS 
_pdbx_chem_comp_pcm.type                               None 
_pdbx_chem_comp_pcm.category                           "Covalent chemical modification" 
_pdbx_chem_comp_pcm.position                           "Amino-acid side chain" 
_pdbx_chem_comp_pcm.polypeptide_position               "Any position" 
_pdbx_chem_comp_pcm.comp_id_linking_atom               C5 
_pdbx_chem_comp_pcm.modified_residue_id_linking_atom   SG 
_pdbx_chem_comp_pcm.uniprot_specific_ptm_accession     ? 
_pdbx_chem_comp_pcm.uniprot_generic_ptm_accession      ? 
# 
