data_HFQ # _chem_comp.id HFQ _chem_comp.name "2,4-dihydroxyphenacyl coenzyme A" _chem_comp.type NON-POLYMER _chem_comp.pdbx_type HETAIN _chem_comp.formula "C29 H42 N7 O19 P3 S" _chem_comp.mon_nstd_parent_comp_id ? _chem_comp.pdbx_synonyms ? _chem_comp.pdbx_formal_charge 0 _chem_comp.pdbx_initial_date 2011-06-10 _chem_comp.pdbx_modified_date 2014-07-25 _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 917.666 _chem_comp.one_letter_code ? _chem_comp.three_letter_code HFQ _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 3SC9 _chem_comp.pdbx_subcomponent_list ? _chem_comp.pdbx_processing_site RCSB # 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.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 HFQ CB CB C 0 1 N N N 9.569 -20.695 -27.451 -12.809 -1.108 0.188 CB HFQ 1 HFQ N1A N1A N 0 1 Y N N -2.439 -23.366 -23.932 7.676 -7.830 -0.475 N1A HFQ 2 HFQ O1A O1A O 0 1 N N N -0.488 -30.565 -17.725 6.326 2.705 -2.238 O1A HFQ 3 HFQ P1A P1A P 0 1 N N N 0.826 -29.599 -17.619 5.821 2.672 -0.847 P1A HFQ 4 HFQ C1B C1B C 0 1 N N N 10.491 -19.522 -27.707 -14.008 -1.581 0.969 C1B HFQ 5 HFQ O1B O1B O 0 1 N N N 11.364 -19.296 -26.954 -14.120 -1.293 2.143 O1B HFQ 6 HFQ C1D C1D C 0 1 N N R -1.195 -25.244 -19.214 7.780 -2.710 0.395 C1D HFQ 7 HFQ S1P S1P S 0 1 N N N 8.129 -20.662 -26.445 -11.726 -0.138 1.273 S1P HFQ 8 HFQ C2A C2A C 0 1 Y N N -2.043 -22.652 -22.801 7.766 -7.190 0.677 C2A HFQ 9 HFQ O2A O2A O 0 1 N N N 1.434 -29.562 -16.294 6.405 3.933 -0.034 O2A HFQ 10 HFQ P2A P2A P 0 1 N N N 1.601 -30.445 -20.280 3.133 3.562 -1.723 P2A HFQ 11 HFQ C2B C2B C 0 1 Y N N 10.257 -18.701 -28.980 -15.038 -2.390 0.312 C2B HFQ 12 HFQ O2B O2B O 0 1 N N N 9.752 -16.371 -32.508 -17.931 -4.666 -1.556 O2B HFQ 13 HFQ C2D C2D C 0 1 N N R -1.831 -26.149 -18.185 9.256 -2.359 0.688 C2D HFQ 14 HFQ O2D O2D O 0 1 N N N -3.240 -26.072 -18.008 9.697 -3.007 1.882 O2D HFQ 15 HFQ C2P C2P C 0 1 N N N 8.791 -20.200 -24.814 -10.364 0.335 0.172 C2P HFQ 16 HFQ N3A N3A N 0 1 Y N N -1.725 -23.367 -21.585 7.782 -5.876 0.756 N3A HFQ 17 HFQ O3A O3A O 0 1 N N N 1.993 -30.038 -18.719 4.213 2.739 -0.858 O3A HFQ 18 HFQ C3B C3B C 0 1 Y N N 11.189 -17.710 -29.281 -14.911 -2.725 -1.043 C3B HFQ 19 HFQ O3B O3B O 0 1 N N N 8.023 -19.817 -29.527 -16.288 -2.520 2.351 O3B HFQ 20 HFQ C3D C3D C 0 1 N N S -0.976 -25.679 -17.043 9.246 -0.825 0.876 C3D HFQ 21 HFQ O3D O3D O 0 1 N N N -1.436 -24.461 -16.515 9.682 -0.479 2.192 O3D HFQ 22 HFQ P3D P3D P 0 1 N N N -2.275 -24.516 -15.104 10.953 0.468 2.474 P3D HFQ 23 HFQ C3P C3P C 0 1 N N N 9.428 -21.410 -24.093 -9.347 1.173 0.949 C3P HFQ 24 HFQ C4A C4A C 0 1 Y N N -1.820 -24.750 -21.564 7.707 -5.130 -0.342 C4A HFQ 25 HFQ O4A O4A O 0 1 N N N 2.669 -31.590 -20.750 3.618 4.945 -1.930 O4A HFQ 26 HFQ C4B C4B C 0 1 Y N N 10.999 -16.902 -30.465 -15.872 -3.478 -1.653 C4B HFQ 27 HFQ C4D C4D C 0 1 N N R 0.470 -25.689 -17.676 7.766 -0.431 0.674 C4D HFQ 28 HFQ O4D O4D O 0 1 N N N 0.221 -25.295 -19.057 7.208 -1.493 -0.131 O4D HFQ 29 HFQ N4P N4P N 0 1 N N N 8.572 -22.596 -23.926 -8.247 1.555 0.060 N4P HFQ 30 HFQ C5A C5A C 0 1 Y N N -2.219 -25.481 -22.697 7.610 -5.764 -1.592 C5A HFQ 31 HFQ O5A O5A O 0 1 N N N 0.222 -30.894 -20.491 2.930 2.845 -3.150 O5A HFQ 32 HFQ C5B C5B C 0 1 Y N N 9.863 -17.141 -31.334 -16.982 -3.919 -0.937 C5B HFQ 33 HFQ C5D C5D C 0 1 N N N 1.217 -27.035 -17.541 7.667 0.905 -0.063 C5D HFQ 34 HFQ O5D O5D O 0 1 N N N 0.380 -28.052 -18.005 6.298 1.308 -0.136 O5D HFQ 35 HFQ C5P C5P C 0 1 N N N 7.336 -22.522 -23.110 -7.228 2.300 0.531 C5P HFQ 36 HFQ O5P O5P O 0 1 N N N 7.006 -21.539 -22.495 -7.221 2.655 1.690 O5P HFQ 37 HFQ C6A C6A C 0 1 Y N N -2.532 -24.782 -23.892 7.596 -7.169 -1.625 C6A HFQ 38 HFQ N6A N6A N 0 1 N N N -2.956 -25.535 -25.064 7.503 -7.848 -2.827 N6A HFQ 39 HFQ O6A O6A O 0 1 N N N 1.793 -28.996 -21.049 1.729 3.598 -0.935 O6A HFQ 40 HFQ C6B C6B C 0 1 Y N N 8.904 -18.164 -31.046 -17.124 -3.596 0.405 C6B HFQ 41 HFQ C6P C6P C 0 1 N N N 6.442 -23.769 -23.084 -6.097 2.694 -0.384 C6P HFQ 42 HFQ N7A N7A N 0 1 Y N N -2.208 -26.856 -22.370 7.548 -4.789 -2.530 N7A HFQ 43 HFQ O7A O7A O 0 1 N N N -3.891 -24.695 -15.388 12.142 -0.085 1.789 O7A HFQ 44 HFQ C7B C7B C 0 1 Y N N 9.066 -18.944 -29.871 -16.155 -2.838 1.039 C7B HFQ 45 HFQ C7P C7P C 0 1 N N N 6.156 -24.135 -21.619 -5.079 3.531 0.394 C7P HFQ 46 HFQ C8A C8A C 0 1 Y N N -1.821 -26.991 -21.035 7.600 -3.625 -1.950 C8A HFQ 47 HFQ O8A O8A O 0 1 N N N -1.707 -25.750 -14.178 10.653 1.949 1.918 O8A HFQ 48 HFQ N8P N8P N 0 1 N N N 5.581 -25.471 -21.467 -3.980 3.913 -0.496 N8P HFQ 49 HFQ N9A N9A N 0 1 Y N N -1.580 -25.672 -20.557 7.698 -3.783 -0.599 N9A HFQ 50 HFQ O9A O9A O 0 1 N N N -1.992 -23.223 -14.476 11.230 0.536 4.059 O9A HFQ 51 HFQ C9P C9P C 0 1 N N N 4.140 -25.555 -21.434 -2.961 4.659 -0.025 C9P HFQ 52 HFQ O9P O9P O 0 1 N N N 3.467 -24.590 -21.650 -2.998 5.092 1.107 O9P HFQ 53 HFQ CAP CAP C 0 1 N N R 3.563 -26.985 -21.240 -1.774 4.955 -0.906 CAP HFQ 54 HFQ OAP OAP O 0 1 N N N 4.602 -27.893 -20.913 -2.075 4.582 -2.252 OAP HFQ 55 HFQ CBP CBP C 0 1 N N N 2.744 -27.413 -22.501 -0.563 4.158 -0.415 CBP HFQ 56 HFQ CCP CCP C 0 1 N N N 2.428 -28.903 -22.293 0.599 4.342 -1.393 CCP HFQ 57 HFQ CDP CDP C 0 1 N N N 1.423 -26.606 -22.517 -0.149 4.661 0.969 CDP HFQ 58 HFQ CEP CEP C 0 1 N N N 3.554 -27.276 -23.823 -0.929 2.675 -0.331 CEP HFQ 59 HFQ HB HB H 0 1 N N N 9.200 -20.976 -28.448 -12.263 -1.969 -0.196 HB HFQ 60 HFQ HBA HBA H 0 1 N N N 10.214 -21.453 -26.982 -13.140 -0.487 -0.644 HBA HFQ 61 HFQ H1D H1D H 0 1 N N N -1.539 -24.209 -19.071 7.270 -3.003 1.313 H1D HFQ 62 HFQ H2A H2A H 0 1 N N N -1.975 -21.575 -22.833 7.830 -7.766 1.588 H2A HFQ 63 HFQ HO2A HO2A H 0 0 N N N 0.945 -30.124 -15.705 6.115 3.975 0.887 HO2A HFQ 64 HFQ HO2B HO2B H 0 0 N N N 8.969 -16.626 -32.982 -17.771 -5.619 -1.513 HO2B HFQ 65 HFQ H2D H2D H 0 1 N N N -1.830 -27.225 -18.412 9.889 -2.639 -0.154 H2D HFQ 66 HFQ HO2D HO2D H 0 0 N N N -3.509 -26.688 -17.337 9.665 -3.973 1.840 HO2D HFQ 67 HFQ H2P H2P H 0 1 N N N 9.560 -19.425 -24.951 -9.878 -0.562 -0.212 H2P HFQ 68 HFQ H2PA H2PA H 0 0 N N N 7.968 -19.813 -24.195 -10.756 0.920 -0.660 H2PA HFQ 69 HFQ H3B H3B H 0 1 N N N 12.042 -17.548 -28.639 -14.054 -2.387 -1.605 H3B HFQ 70 HFQ HO3B HO3B H 0 0 N N N 7.375 -19.826 -30.222 -15.896 -3.165 2.954 HO3B HFQ 71 HFQ H3D H3D H 0 1 N N N -0.998 -26.308 -16.141 9.877 -0.345 0.127 H3D HFQ 72 HFQ H3P H3P H 0 1 N N N 10.302 -21.719 -24.685 -9.832 2.070 1.333 H3P HFQ 73 HFQ H3PA H3PA H 0 0 N N N 9.719 -21.074 -23.087 -8.955 0.588 1.781 H3PA HFQ 74 HFQ H4B H4B H 0 1 N N N 11.704 -16.119 -30.702 -15.770 -3.734 -2.697 H4B HFQ 75 HFQ H4D H4D H 0 1 N N N 1.159 -25.010 -17.152 7.255 -0.373 1.635 H4D HFQ 76 HFQ HN4P HN4P H 0 0 N N N 8.826 -23.457 -24.366 -8.252 1.271 -0.868 HN4P HFQ 77 HFQ HO5A HO5A H 0 0 N N N 0.227 -31.769 -20.862 2.612 1.934 -3.091 HO5A HFQ 78 HFQ H5D H5D H 0 1 N N N 2.141 -27.011 -18.138 8.239 1.661 0.475 H5D HFQ 79 HFQ H5DA H5DA H 0 0 N N N 1.474 -27.215 -16.487 8.067 0.795 -1.071 H5DA HFQ 80 HFQ HN6A HN6A H 0 0 N N N -3.145 -24.904 -25.816 7.495 -8.818 -2.836 HN6A HFQ 81 HFQ HN6B HN6B H 0 0 N N N -2.230 -26.167 -25.334 7.445 -7.355 -3.660 HN6B HFQ 82 HFQ H6B H6B H 0 1 N N N 8.071 -18.339 -31.711 -17.987 -3.941 0.955 H6B HFQ 83 HFQ H6P H6P H 0 1 N N N 5.497 -23.560 -23.607 -5.611 1.796 -0.768 H6P HFQ 84 HFQ H6PA H6PA H 0 0 N N N 6.954 -24.605 -23.583 -6.489 3.278 -1.216 H6PA HFQ 85 HFQ H7P H7P H 0 1 N N N 7.104 -24.101 -21.063 -5.565 4.428 0.777 H7P HFQ 86 HFQ H7PA H7PA H 0 0 N N N 5.443 -23.403 -21.212 -4.687 2.946 1.225 H7PA HFQ 87 HFQ H8A H8A H 0 1 N N N -1.724 -27.911 -20.477 7.570 -2.675 -2.462 H8A HFQ 88 HFQ HO8A HO8A H 0 0 N N N -2.418 -26.346 -13.973 9.884 2.373 2.324 HO8A HFQ 89 HFQ HN8P HN8P H 0 0 N N N 6.157 -26.285 -21.390 -3.985 3.629 -1.423 HN8P HFQ 90 HFQ HO9A HO9A H 0 0 N N N -2.804 -22.744 -14.358 11.983 1.091 4.303 HO9A HFQ 91 HFQ HAP HAP H 0 1 N N N 2.862 -26.992 -20.393 -1.548 6.021 -0.865 HAP HFQ 92 HFQ HOAP HOAP H 0 0 N N N 4.238 -28.763 -20.797 -2.286 3.645 -2.363 HOAP HFQ 93 HFQ HCP HCP H 0 1 N N N 3.352 -29.499 -22.301 0.859 5.399 -1.454 HCP HFQ 94 HFQ HCPA HCPA H 0 0 N N N 1.770 -29.274 -23.092 0.303 3.984 -2.380 HCPA HFQ 95 HFQ HDP HDP H 0 1 N N N 0.829 -26.891 -23.398 -0.947 4.459 1.683 HDP HFQ 96 HFQ HDPA HDPA H 0 0 N N N 0.850 -26.822 -21.603 0.759 4.148 1.285 HDPA HFQ 97 HFQ HDPB HDPB H 0 0 N N N 1.651 -25.531 -22.561 0.036 5.734 0.925 HDPB HFQ 98 HFQ HEP HEP H 0 1 N N N 2.928 -27.590 -24.671 -1.224 2.317 -1.317 HEP HFQ 99 HFQ HEPA HEPA H 0 0 N N N 3.857 -26.228 -23.960 -0.067 2.108 0.019 HEPA HFQ 100 HFQ HEPB HEPB H 0 0 N N N 4.449 -27.913 -23.772 -1.757 2.544 0.366 HEPB HFQ 101 # 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 HFQ C1B CB SING N N 1 HFQ CB S1P SING N N 2 HFQ CB HB SING N N 3 HFQ CB HBA SING N N 4 HFQ N1A C6A DOUB Y N 5 HFQ N1A C2A SING Y N 6 HFQ O1A P1A DOUB N N 7 HFQ O3A P1A SING N N 8 HFQ O5D P1A SING N N 9 HFQ P1A O2A SING N N 10 HFQ C2B C1B SING N N 11 HFQ C1B O1B DOUB N N 12 HFQ N9A C1D SING N N 13 HFQ C1D O4D SING N N 14 HFQ C1D C2D SING N N 15 HFQ C1D H1D SING N N 16 HFQ S1P C2P SING N N 17 HFQ C2A N3A DOUB Y N 18 HFQ C2A H2A SING N N 19 HFQ O2A HO2A SING N N 20 HFQ O6A P2A SING N N 21 HFQ O4A P2A DOUB N N 22 HFQ O5A P2A SING N N 23 HFQ P2A O3A SING N N 24 HFQ C7B C2B DOUB Y N 25 HFQ C3B C2B SING Y N 26 HFQ O2B C5B SING N N 27 HFQ O2B HO2B SING N N 28 HFQ C2D O2D SING N N 29 HFQ C2D C3D SING N N 30 HFQ C2D H2D SING N N 31 HFQ O2D HO2D SING N N 32 HFQ C2P C3P SING N N 33 HFQ C2P H2P SING N N 34 HFQ C2P H2PA SING N N 35 HFQ N3A C4A SING Y N 36 HFQ C4B C3B DOUB Y N 37 HFQ C3B H3B SING N N 38 HFQ C7B O3B SING N N 39 HFQ O3B HO3B SING N N 40 HFQ C4D C3D SING N N 41 HFQ C3D O3D SING N N 42 HFQ C3D H3D SING N N 43 HFQ O3D P3D SING N N 44 HFQ O7A P3D DOUB N N 45 HFQ P3D O9A SING N N 46 HFQ P3D O8A SING N N 47 HFQ C3P N4P SING N N 48 HFQ C3P H3P SING N N 49 HFQ C3P H3PA SING N N 50 HFQ C5A C4A DOUB Y N 51 HFQ C4A N9A SING Y N 52 HFQ C5B C4B SING Y N 53 HFQ C4B H4B SING N N 54 HFQ O4D C4D SING N N 55 HFQ C4D C5D SING N N 56 HFQ C4D H4D SING N N 57 HFQ N4P C5P SING N N 58 HFQ N4P HN4P SING N N 59 HFQ C6A C5A SING Y N 60 HFQ C5A N7A SING Y N 61 HFQ O5A HO5A SING N N 62 HFQ C5B C6B DOUB Y N 63 HFQ O5D C5D SING N N 64 HFQ C5D H5D SING N N 65 HFQ C5D H5DA SING N N 66 HFQ C5P C6P SING N N 67 HFQ C5P O5P DOUB N N 68 HFQ N6A C6A SING N N 69 HFQ N6A HN6A SING N N 70 HFQ N6A HN6B SING N N 71 HFQ CCP O6A SING N N 72 HFQ C6B C7B SING Y N 73 HFQ C6B H6B SING N N 74 HFQ C6P C7P SING N N 75 HFQ C6P H6P SING N N 76 HFQ C6P H6PA SING N N 77 HFQ N7A C8A DOUB Y N 78 HFQ C7P N8P SING N N 79 HFQ C7P H7P SING N N 80 HFQ C7P H7PA SING N N 81 HFQ C8A N9A SING Y N 82 HFQ C8A H8A SING N N 83 HFQ O8A HO8A SING N N 84 HFQ N8P C9P SING N N 85 HFQ N8P HN8P SING N N 86 HFQ O9A HO9A SING N N 87 HFQ O9P C9P DOUB N N 88 HFQ C9P CAP SING N N 89 HFQ CBP CAP SING N N 90 HFQ CAP OAP SING N N 91 HFQ CAP HAP SING N N 92 HFQ OAP HOAP SING N N 93 HFQ CEP CBP SING N N 94 HFQ CDP CBP SING N N 95 HFQ CBP CCP SING N N 96 HFQ CCP HCP SING N N 97 HFQ CCP HCPA SING N N 98 HFQ CDP HDP SING N N 99 HFQ CDP HDPA SING N N 100 HFQ CDP HDPB SING N N 101 HFQ CEP HEP SING N N 102 HFQ CEP HEPA SING N N 103 HFQ CEP HEPB SING N N 104 # 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 HFQ SMILES ACDLabs 12.01 "O=C(c1ccc(O)cc1O)CSCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC4OC(n3cnc2c(ncnc23)N)C(O)C4OP(=O)(O)O" HFQ InChI InChI 1.03 ;InChI=1S/C29H42N7O19P3S/c1-29(2,24(42)27(43)32-6-5-20(40)31-7-8-59-11-18(39)16-4-3-15(37)9-17(16)38)12-52-58(49,50)55-57(47,48)51-10-19-23(54-56(44,45)46)22(41)28(53-19)36-14-35-21-25(30)33-13-34-26(21)36/h3-4,9,13-14,19,22-24,28,37-38,41-42H,5-8,10-12H2,1-2H3,(H,31,40)(H,32,43)(H,47,48)(H,49,50)(H2,30,33,34)(H2,44,45,46)/t19-,22-,23-,24+,28-/m1/s1 ; HFQ InChIKey InChI 1.03 WNZSFAUZOOBNIR-VXAHOBLNSA-N HFQ SMILES_CANONICAL CACTVS 3.370 "CC(C)(CO[P](O)(=O)O[P](O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O[P](O)(O)=O)n2cnc3c(N)ncnc23)[C@@H](O)C(=O)NCCC(=O)NCCSCC(=O)c4ccc(O)cc4O" HFQ SMILES CACTVS 3.370 "CC(C)(CO[P](O)(=O)O[P](O)(=O)OC[CH]1O[CH]([CH](O)[CH]1O[P](O)(O)=O)n2cnc3c(N)ncnc23)[CH](O)C(=O)NCCC(=O)NCCSCC(=O)c4ccc(O)cc4O" HFQ SMILES_CANONICAL "OpenEye OEToolkits" 1.7.2 "CC(C)(CO[P@](=O)(O)O[P@@](=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)n2cnc3c2ncnc3N)O)OP(=O)(O)O)[C@H](C(=O)NCCC(=O)NCCSCC(=O)c4ccc(cc4O)O)O" HFQ SMILES "OpenEye OEToolkits" 1.7.2 "CC(C)(COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)n2cnc3c2ncnc3N)O)OP(=O)(O)O)C(C(=O)NCCC(=O)NCCSCC(=O)c4ccc(cc4O)O)O" # 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 HFQ "SYSTEMATIC NAME" ACDLabs 12.01 ;[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]methyl (3R)-4-({3-[(2-{[2-(2,4-dihydroxyphenyl)-2-oxoethyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl dihydrogen diphosphate (non-preferred name) ; HFQ "SYSTEMATIC NAME" "OpenEye OEToolkits" 1.7.2 ;[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-oxidanyl-3-phosphonooxy-oxolan-2-yl]methoxy-oxidanyl-phosphoryl] [(3R)-4-[[3-[2-[2-[2,4-bis(oxidanyl)phenyl]-2-oxidanylidene-ethyl]sulfanylethylamino]-3-oxidanylidene-propyl]amino]-2,2-dimethyl-3-oxidanyl-4-oxidanylidene-butyl] hydrogen phosphate ; # loop_ _pdbx_chem_comp_audit.comp_id _pdbx_chem_comp_audit.action_type _pdbx_chem_comp_audit.date _pdbx_chem_comp_audit.processing_site HFQ "Create component" 2011-06-10 RCSB HFQ "Initial release" 2014-07-30 RCSB #