data_A1CG4
# 
_chem_comp.id                                    A1CG4 
_chem_comp.name                                  "methyl (3S)-3-{[(7P)-7-(2-amino-3-cyano-7-fluoro-1-benzothiophen-4-yl)-8-fluoro-2-{[(2R,4R,7aS)-2-fluorotetrahydro-1H-pyrrolizin-7a(5H)-yl]methoxy}-6-(trifluoromethyl)quinazolin-4-yl](ethyl)amino}pyrrolidine-1-carboxylate" 
_chem_comp.type                                  non-polymer 
_chem_comp.pdbx_type                             HETAIN 
_chem_comp.formula                               "C34 H33 F6 N7 O3 S" 
_chem_comp.mon_nstd_parent_comp_id               ? 
_chem_comp.pdbx_synonyms                         ? 
_chem_comp.pdbx_formal_charge                    0 
_chem_comp.pdbx_initial_date                     2025-06-17 
_chem_comp.pdbx_modified_date                    2025-11-28 
_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                        733.726 
_chem_comp.one_letter_code                       ? 
_chem_comp.three_letter_code                     A1CG4 
_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        9P46 
_chem_comp.pdbx_subcomponent_list                ? 
_chem_comp.pdbx_processing_site                  RCSB 
_chem_comp.pdbx_pcm                              ? 
# 
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 
A1CG4 N1  N1  N 0 1 Y N N N N N 63.421 -5.252  -25.707 2.141  -0.475 -0.730 N1  A1CG4 1  
A1CG4 N3  N2  N 0 1 N N N N N N 59.585 -13.110 -28.332 -6.100 1.216  -3.209 N3  A1CG4 2  
A1CG4 C4  C1  C 0 1 Y N N N N N 61.991 -7.460  -24.983 -0.322 0.280  0.132  C4  A1CG4 3  
A1CG4 C5  C2  C 0 1 Y N N N N N 63.963 -8.872  -24.928 -1.096 -2.025 -0.079 C5  A1CG4 4  
A1CG4 C6  C3  C 0 1 Y N N N N N 63.214 -9.957  -24.562 -2.329 -1.643 0.352  C6  A1CG4 5  
A1CG4 C7  C4  C 0 1 Y N N N N N 61.832 -9.817  -24.360 -2.591 -0.304 0.683  C7  A1CG4 6  
A1CG4 C8  C5  C 0 1 Y N N N N N 61.229 -8.575  -24.586 -1.596 0.657  0.576  C8  A1CG4 7  
A1CG4 C10 C6  C 0 1 Y N N N N N 60.372 -11.809 -24.949 -4.925 0.493  0.212  C10 A1CG4 8  
A1CG4 C13 C7  C 0 1 Y N N N N N 59.871 -12.270 -22.228 -5.500 0.415  2.946  C13 A1CG4 9  
A1CG4 C15 C8  C 0 1 Y N N N N N 60.450 -11.786 -26.409 -4.814 0.603  -1.242 C15 A1CG4 10 
A1CG4 C17 C9  C 0 1 N N N N N N 62.274 -2.908  -25.750 2.510  3.055  -0.168 C17 A1CG4 11 
A1CG4 C20 C10 C 0 1 N N S N N N 61.292 -1.748  -25.854 3.735  3.953  -0.354 C20 A1CG4 12 
A1CG4 C21 C11 C 0 1 N N N N N N 58.963 -2.194  -26.401 4.347  5.807  1.064  C21 A1CG4 13 
A1CG4 C22 C12 C 0 1 N N R N N N 59.002 -1.501  -25.050 4.786  4.460  1.767  C22 A1CG4 14 
A1CG4 C24 C13 C 0 1 N N N N N N 62.045 -0.470  -26.211 4.210  3.932  -1.821 C24 A1CG4 15 
A1CG4 C26 C14 C 0 1 N N N N N N 60.393 -0.769  -27.906 3.615  6.183  -1.225 C26 A1CG4 16 
A1CG4 C28 C15 C 0 1 N N N N N N 66.413 -2.881  -26.812 4.141  -5.074 0.199  C28 A1CG4 17 
A1CG4 C1  C16 C 0 1 Y N N N N N 62.102 -5.241  -25.547 1.865  0.784  -0.410 C1  A1CG4 18 
A1CG4 C11 C17 C 0 1 Y N N N N N 59.532 -12.864 -24.503 -6.187 0.855  0.672  C11 A1CG4 19 
A1CG4 C12 C18 C 0 1 Y N N N N N 59.286 -13.085 -23.153 -6.465 0.812  2.044  C12 A1CG4 20 
A1CG4 C14 C19 C 0 1 Y N N N N N 60.683 -11.209 -22.635 -4.240 0.052  2.503  C14 A1CG4 21 
A1CG4 C16 C20 C 0 1 Y N N N N N 59.730 -12.803 -27.025 -5.958 1.034  -1.850 C16 A1CG4 22 
A1CG4 C18 C21 C 0 1 N N S N N N 66.221 -5.079  -25.901 2.512  -3.300 -0.050 C18 A1CG4 23 
A1CG4 C19 C22 C 0 1 N N N N N N 66.211 -7.519  -26.376 1.997  -2.822 -2.368 C19 A1CG4 24 
A1CG4 C2  C23 C 0 1 Y N N N N N 64.094 -6.407  -25.577 1.224  -1.429 -0.643 C2  A1CG4 25 
A1CG4 C23 C24 C 0 1 N N N N N N 60.458 -1.649  -24.580 4.893  3.496  0.557  C23 A1CG4 26 
A1CG4 C25 C25 C 0 1 N N N N N N 61.073 0.316   -27.071 4.649  5.399  -2.071 C25 A1CG4 27 
A1CG4 C27 C26 C 0 1 N N N N N N 65.884 -4.248  -27.156 2.704  -4.818 -0.304 C27 A1CG4 28 
A1CG4 C29 C27 C 0 1 N N N N N N 65.947 -4.102  -24.757 3.931  -2.753 -0.345 C29 A1CG4 29 
A1CG4 C3  C28 C 0 1 Y N N N N N 63.384 -7.605  -25.172 -0.073 -1.076 -0.198 C3  A1CG4 30 
A1CG4 C30 C29 C 0 1 N N N N N N 66.162 -1.647  -24.669 6.123  -3.581 0.558  C30 A1CG4 31 
A1CG4 C31 C30 C 0 1 N N N N N N 67.291 -8.126  -25.513 0.823  -2.589 -3.321 C31 A1CG4 32 
A1CG4 C32 C31 C 0 1 N N N N N N 66.393 0.678   -24.780 8.227  -4.317 1.413  C32 A1CG4 33 
A1CG4 C33 C32 C 0 1 N N N N N N 63.904 -11.262 -24.303 -3.425 -2.669 0.477  C33 A1CG4 34 
A1CG4 C34 C33 C 0 1 N N N N N N 61.238 -10.869 -27.155 -3.617 0.288  -1.962 C34 A1CG4 35 
A1CG4 C9  C34 C 0 1 Y N N N N N 60.962 -10.954 -23.980 -3.941 0.086  1.151  C9  A1CG4 36 
A1CG4 F1  F1  F 0 1 N N N N N N 58.497 -14.102 -22.769 -7.691 1.164  2.490  F1  A1CG4 37 
A1CG4 F2  F2  F 0 1 N N N N N N 59.896 -8.413  -24.430 -1.854 1.944  0.895  F2  A1CG4 38 
A1CG4 F3  F3  F 0 1 N N N N N N 58.714 -0.150  -25.177 6.023  4.607  2.403  F3  A1CG4 39 
A1CG4 F4  F4  F 0 1 N N N N N N 65.231 -11.193 -24.431 -4.493 -2.313 -0.354 F4  A1CG4 40 
A1CG4 F5  F5  F 0 1 N N N N N N 63.795 -11.633 -23.026 -2.936 -3.923 0.096  F5  A1CG4 41 
A1CG4 F6  F6  F 0 1 N N N N N N 63.409 -12.255 -24.983 -3.864 -2.724 1.804  F6  A1CG4 42 
A1CG4 N2  N3  N 0 1 Y N N N N N 61.358 -6.265  -25.166 0.677  1.169  0.009  N2  A1CG4 43 
A1CG4 N4  N4  N 0 1 N N N N N N 65.449 -6.348  -25.873 1.526  -2.731 -0.979 N4  A1CG4 44 
A1CG4 N5  N5  N 0 1 N N N N N N 60.300 -1.926  -26.975 3.421  5.352  0.005  N5  A1CG4 45 
A1CG4 N6  N6  N 0 1 N N N N N N 66.161 -2.787  -25.374 4.848  -3.785 0.172  N6  A1CG4 46 
A1CG4 N7  N7  N 0 1 N N N N N N 61.874 -10.132 -27.756 -2.667 0.039  -2.532 N7  A1CG4 47 
A1CG4 O1  O1  O 0 1 N N N N N N 61.467 -4.081  -25.657 2.845  1.712  -0.520 O1  A1CG4 48 
A1CG4 O2  O2  O 0 1 N N N N N N 66.346 -0.596  -25.463 6.861  -4.610 1.015  O2  A1CG4 49 
A1CG4 O3  O3  O 0 1 N N N N N N 66.055 -1.598  -23.465 6.607  -2.469 0.492  O3  A1CG4 50 
A1CG4 S1  S1  S 0 1 Y N N N N N 58.898 -13.767 -25.839 -7.223 1.318  -0.672 S1  A1CG4 51 
A1CG4 H1  H1  H 0 1 N N N N N N 58.979 -13.900 -28.424 -5.355 1.035  -3.803 H1  A1CG4 52 
A1CG4 H2  H2  H 0 1 N N N N N N 59.190 -12.329 -28.816 -6.944 1.526  -3.571 H2  A1CG4 53 
A1CG4 H3  H3  H 0 1 N N N N N N 65.032 -8.987  -25.034 -0.908 -3.058 -0.330 H3  A1CG4 54 
A1CG4 H4  H4  H 0 1 N N N N N N 59.705 -12.446 -21.175 -5.728 0.387  4.001  H4  A1CG4 55 
A1CG4 H5  H5  H 0 1 N N N N N N 62.914 -2.951  -26.643 2.191  3.089  0.874  H5  A1CG4 56 
A1CG4 H6  H6  H 0 1 N N N N N N 62.902 -2.801  -24.853 1.701  3.408  -0.807 H6  A1CG4 57 
A1CG4 H7  H7  H 0 1 N N N N N N 58.172 -1.769  -27.036 3.829  6.453  1.773  H7  A1CG4 58 
A1CG4 H8  H8  H 0 1 N N N N N N 58.797 -3.275  -26.282 5.216  6.319  0.651  H8  A1CG4 59 
A1CG4 H9  H9  H 0 1 N N N N N N 58.326 -2.006  -24.344 4.025  4.121  2.471  H9  A1CG4 60 
A1CG4 H10 H10 H 0 1 N N N N N N 62.961 -0.703  -26.773 5.054  3.252  -1.943 H10 A1CG4 61 
A1CG4 H11 H11 H 0 1 N N N N N N 62.305 0.094   -25.303 3.394  3.653  -2.487 H11 A1CG4 62 
A1CG4 H12 H12 H 0 1 N N N N N N 59.393 -0.445  -28.230 4.010  7.162  -0.956 H12 A1CG4 63 
A1CG4 H13 H13 H 0 1 N N N N N N 61.000 -1.023  -28.788 2.678  6.288  -1.773 H13 A1CG4 64 
A1CG4 H14 H14 H 0 1 N N N N N N 67.488 -2.806  -27.031 4.113  -5.460 1.218  H14 A1CG4 65 
A1CG4 H15 H15 H 0 1 N N N N N N 65.871 -2.097  -27.361 4.643  -5.787 -0.454 H15 A1CG4 66 
A1CG4 H16 H16 H 0 1 N N N N N N 61.111 -10.562 -21.883 -3.488 -0.258 3.214  H16 A1CG4 67 
A1CG4 H17 H17 H 0 1 N N N N N N 67.296 -5.310  -25.915 2.227  -3.109 0.984  H17 A1CG4 68 
A1CG4 H18 H18 H 0 1 N N N N N N 65.479 -8.314  -26.580 2.418  -3.811 -2.545 H18 A1CG4 69 
A1CG4 H19 H19 H 0 1 N N N N N N 66.689 -7.210  -27.317 2.762  -2.065 -2.542 H19 A1CG4 70 
A1CG4 H20 H20 H 0 1 N N N N N N 60.575 -2.559  -23.973 4.750  2.463  0.873  H20 A1CG4 71 
A1CG4 H21 H21 H 0 1 N N N N N N 60.762 -0.772  -23.989 5.851  3.617  0.051  H21 A1CG4 72 
A1CG4 H22 H22 H 0 1 N N N N N N 61.605 1.033   -27.713 5.663  5.577  -1.713 H22 A1CG4 73 
A1CG4 H23 H23 H 0 1 N N N N N N 60.341 0.853   -26.450 4.561  5.650  -3.128 H23 A1CG4 74 
A1CG4 H24 H24 H 0 1 N N N N N N 64.798 -4.219  -27.331 2.622  -5.045 -1.367 H24 A1CG4 75 
A1CG4 H25 H25 H 0 1 N N N N N N 66.388 -4.654  -28.046 1.985  -5.399 0.273  H25 A1CG4 76 
A1CG4 H26 H26 H 0 1 N N N N N N 64.914 -4.202  -24.393 4.073  -2.624 -1.418 H26 A1CG4 77 
A1CG4 H27 H27 H 0 1 N N N N N N 66.647 -4.265  -23.924 4.089  -1.808 0.174  H27 A1CG4 78 
A1CG4 H28 H28 H 0 1 N N N N N N 67.747 -8.977  -26.040 1.151  -2.751 -4.347 H28 A1CG4 79 
A1CG4 H29 H29 H 0 1 N N N N N N 68.062 -7.369  -25.304 0.019  -3.285 -3.083 H29 A1CG4 80 
A1CG4 H30 H30 H 0 1 N N N N N N 66.852 -8.473  -24.566 0.463  -1.567 -3.211 H30 A1CG4 81 
A1CG4 H31 H31 H 0 1 N N N N N N 66.547 1.483   -25.514 8.776  -3.920 0.559  H31 A1CG4 82 
A1CG4 H32 H32 H 0 1 N N N N N N 65.445 0.844   -24.248 8.221  -3.581 2.216  H32 A1CG4 83 
A1CG4 H33 H33 H 0 1 N N N N N N 67.223 0.676   -24.058 8.708  -5.231 1.760  H33 A1CG4 84 
# 
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 
A1CG4 N3  C16 SING N N 1  
A1CG4 C26 C25 SING N N 2  
A1CG4 C26 N5  SING N N 3  
A1CG4 N7  C34 TRIP N N 4  
A1CG4 C27 C28 SING N N 5  
A1CG4 C27 C18 SING N N 6  
A1CG4 C34 C15 SING N N 7  
A1CG4 C25 C24 SING N N 8  
A1CG4 C16 C15 DOUB Y N 9  
A1CG4 C16 S1  SING Y N 10 
A1CG4 N5  C21 SING N N 11 
A1CG4 N5  C20 SING N N 12 
A1CG4 C28 N6  SING N N 13 
A1CG4 C15 C10 SING Y N 14 
A1CG4 C21 C22 SING N N 15 
A1CG4 C19 N4  SING N N 16 
A1CG4 C19 C31 SING N N 17 
A1CG4 C24 C20 SING N N 18 
A1CG4 C18 N4  SING N N 19 
A1CG4 C18 C29 SING N N 20 
A1CG4 N4  C2  SING N N 21 
A1CG4 C20 C17 SING N N 22 
A1CG4 C20 C23 SING N N 23 
A1CG4 S1  C11 SING Y N 24 
A1CG4 C17 O1  SING N N 25 
A1CG4 N1  C2  SING Y N 26 
A1CG4 N1  C1  DOUB Y N 27 
A1CG4 O1  C1  SING N N 28 
A1CG4 C2  C3  DOUB Y N 29 
A1CG4 C1  N2  SING Y N 30 
A1CG4 O2  C32 SING N N 31 
A1CG4 O2  C30 SING N N 32 
A1CG4 N6  C29 SING N N 33 
A1CG4 N6  C30 SING N N 34 
A1CG4 F3  C22 SING N N 35 
A1CG4 C3  C4  SING Y N 36 
A1CG4 C3  C5  SING Y N 37 
A1CG4 N2  C4  DOUB Y N 38 
A1CG4 C22 C23 SING N N 39 
A1CG4 F6  C33 SING N N 40 
A1CG4 C4  C8  SING Y N 41 
A1CG4 C10 C11 DOUB Y N 42 
A1CG4 C10 C9  SING Y N 43 
A1CG4 C5  C6  DOUB Y N 44 
A1CG4 C30 O3  DOUB N N 45 
A1CG4 C8  F2  SING N N 46 
A1CG4 C8  C7  DOUB Y N 47 
A1CG4 C6  C7  SING Y N 48 
A1CG4 C6  C33 SING N N 49 
A1CG4 C11 C12 SING Y N 50 
A1CG4 F4  C33 SING N N 51 
A1CG4 C7  C9  SING N N 52 
A1CG4 C33 F5  SING N N 53 
A1CG4 C9  C14 DOUB Y N 54 
A1CG4 C12 F1  SING N N 55 
A1CG4 C12 C13 DOUB Y N 56 
A1CG4 C14 C13 SING Y N 57 
A1CG4 N3  H1  SING N N 58 
A1CG4 N3  H2  SING N N 59 
A1CG4 C5  H3  SING N N 60 
A1CG4 C13 H4  SING N N 61 
A1CG4 C17 H5  SING N N 62 
A1CG4 C17 H6  SING N N 63 
A1CG4 C21 H7  SING N N 64 
A1CG4 C21 H8  SING N N 65 
A1CG4 C22 H9  SING N N 66 
A1CG4 C24 H10 SING N N 67 
A1CG4 C24 H11 SING N N 68 
A1CG4 C26 H12 SING N N 69 
A1CG4 C26 H13 SING N N 70 
A1CG4 C28 H14 SING N N 71 
A1CG4 C28 H15 SING N N 72 
A1CG4 C14 H16 SING N N 73 
A1CG4 C18 H17 SING N N 74 
A1CG4 C19 H18 SING N N 75 
A1CG4 C19 H19 SING N N 76 
A1CG4 C23 H20 SING N N 77 
A1CG4 C23 H21 SING N N 78 
A1CG4 C25 H22 SING N N 79 
A1CG4 C25 H23 SING N N 80 
A1CG4 C27 H24 SING N N 81 
A1CG4 C27 H25 SING N N 82 
A1CG4 C29 H26 SING N N 83 
A1CG4 C29 H27 SING N N 84 
A1CG4 C31 H28 SING N N 85 
A1CG4 C31 H29 SING N N 86 
A1CG4 C31 H30 SING N N 87 
A1CG4 C32 H31 SING N N 88 
A1CG4 C32 H32 SING N N 89 
A1CG4 C32 H33 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 
A1CG4 SMILES           ACDLabs              14.52   "O=C(OC)N1CCC(C1)N(CC)c1nc(OCC23CCCN3CC(F)C2)nc2c1cc(c(c1ccc(F)c3sc(N)c(C#N)c13)c2F)C(F)(F)F"                                                                                                                                                                 
A1CG4 InChI            InChI                1.06    "InChI=1S/C34H33F6N7O3S/c1-3-47(18-7-10-45(15-18)32(48)49-2)30-20-11-22(34(38,39)40)25(19-5-6-23(36)28-24(19)21(13-41)29(42)51-28)26(37)27(20)43-31(44-30)50-16-33-8-4-9-46(33)14-17(35)12-33/h5-6,11,17-18H,3-4,7-10,12,14-16,42H2,1-2H3/t17-,18+,33+/m1/s1" 
A1CG4 InChIKey         InChI                1.06    VJMZMAQRBQSNHW-AXZPFCHASA-N                                                                                                                                                                                                                                   
A1CG4 SMILES_CANONICAL CACTVS               3.385   "CCN([C@H]1CCN(C1)C(=O)OC)c2nc(OC[C@@]34CCCN3C[C@H](F)C4)nc5c(F)c(c6ccc(F)c7sc(N)c(C#N)c67)c(cc25)C(F)(F)F"                                                                                                                                                   
A1CG4 SMILES           CACTVS               3.385   "CCN([CH]1CCN(C1)C(=O)OC)c2nc(OC[C]34CCCN3C[CH](F)C4)nc5c(F)c(c6ccc(F)c7sc(N)c(C#N)c67)c(cc25)C(F)(F)F"                                                                                                                                                       
A1CG4 SMILES_CANONICAL "OpenEye OEToolkits" 3.1.0.0 "CCN(c1c2cc(c(c(c2nc(n1)OC[C@@]34CCCN3C[C@@H](C4)F)F)c5ccc(c6c5c(c(s6)N)C#N)F)C(F)(F)F)[C@H]7CCN(C7)C(=O)OC"                                                                                                                                                  
A1CG4 SMILES           "OpenEye OEToolkits" 3.1.0.0 "CCN(c1c2cc(c(c(c2nc(n1)OCC34CCCN3CC(C4)F)F)c5ccc(c6c5c(c(s6)N)C#N)F)C(F)(F)F)C7CCN(C7)C(=O)OC"                                                                                                                                                               
# 
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 
A1CG4 "SYSTEMATIC NAME" ACDLabs              14.52   "methyl (3S)-3-{[(7P)-7-(2-amino-3-cyano-7-fluoro-1-benzothiophen-4-yl)-8-fluoro-2-{[(2R,4R,7aS)-2-fluorotetrahydro-1H-pyrrolizin-7a(5H)-yl]methoxy}-6-(trifluoromethyl)quinazolin-4-yl](ethyl)amino}pyrrolidine-1-carboxylate"              
A1CG4 "SYSTEMATIC NAME" "OpenEye OEToolkits" 3.1.0.0 "methyl (3~{S})-3-[[7-(2-azanyl-3-cyano-7-fluoranyl-1-benzothiophen-4-yl)-8-fluoranyl-2-[[(2~{R},8~{S})-2-fluoranyl-1,2,3,5,6,7-hexahydropyrrolizin-8-yl]methoxy]-6-(trifluoromethyl)quinazolin-4-yl]-ethyl-amino]pyrrolidine-1-carboxylate" 
# 
loop_
_pdbx_chem_comp_audit.comp_id 
_pdbx_chem_comp_audit.action_type 
_pdbx_chem_comp_audit.date 
_pdbx_chem_comp_audit.processing_site 
A1CG4 "Create component" 2025-06-17 RCSB 
A1CG4 "Initial release"  2025-12-03 RCSB 
# 
