data_MC0 # _chem_comp.id MC0 _chem_comp.name "(S)-Methylmalonyl-Coenzyme A" _chem_comp.type non-polymer _chem_comp.pdbx_type HETAIN _chem_comp.formula "C25 H40 N7 O19 P3 S" _chem_comp.mon_nstd_parent_comp_id ? _chem_comp.pdbx_synonyms "(3S,5R,9R,20S)-1-[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]-3,5,9-trihydroxy-8,8,20-trimethyl-10,14,19-trioxo-2,4,6-trioxa-18-thia-11,15-diaza-3,5-diphosphahenicosan-21-oic acid 3,5-dioxide (non-preferred name)" _chem_comp.pdbx_formal_charge 0 _chem_comp.pdbx_initial_date 2020-06-11 _chem_comp.pdbx_modified_date 2021-03-13 _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 867.607 _chem_comp.one_letter_code ? _chem_comp.three_letter_code MC0 _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 6WF7 _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 MC0 C8 C1 C 0 1 Y N N 13.164 0.606 2.958 -2.890 -3.808 -0.152 C8 MC0 1 MC0 N9 N1 N 0 1 Y N N 12.447 1.253 3.914 -4.003 -3.682 -0.928 N9 MC0 2 MC0 C4 C2 C 0 1 Y N N 12.675 2.603 3.740 -4.040 -4.763 -1.773 C4 MC0 3 MC0 C5 C3 C 0 1 Y N N 13.478 2.685 2.616 -2.905 -5.533 -1.466 C5 MC0 4 MC0 N7 N2 N 0 1 Y N N 13.806 1.423 2.130 -2.244 -4.891 -0.472 N7 MC0 5 MC0 N3 N3 N 0 1 Y N N 12.166 3.615 4.441 -4.862 -5.178 -2.730 N3 MC0 6 MC0 C2 C4 C 0 1 Y N N 12.593 4.759 3.931 -4.621 -6.295 -3.384 C2 MC0 7 MC0 N1 N4 N 0 1 Y N N 13.384 5.011 2.869 -3.569 -7.051 -3.131 N1 MC0 8 MC0 C6 C5 C 0 1 Y N N 13.862 3.961 2.160 -2.690 -6.716 -2.192 C6 MC0 9 MC0 N6 N5 N 0 1 N N N 14.639 4.191 1.091 -1.590 -7.516 -1.934 N6 MC0 10 MC0 "C1'" C6 C 0 1 N N R 11.610 0.623 4.950 -4.981 -2.593 -0.872 "C1'" MC0 11 MC0 "C2'" C7 C 0 1 N N R 10.558 -0.301 4.328 -6.131 -2.953 0.095 "C2'" MC0 12 MC0 "O2'" O1 O 0 1 N N N 9.421 0.416 3.910 -7.260 -3.444 -0.631 "O2'" MC0 13 MC0 "C3'" C8 C 0 1 N N S 10.277 -1.225 5.512 -6.473 -1.614 0.787 "C3'" MC0 14 MC0 "O3'" O2 O 0 1 N N N 9.425 -0.514 6.373 -7.823 -1.238 0.510 "O3'" MC0 15 MC0 "C4'" C9 C 0 1 N N R 11.668 -1.395 6.115 -5.489 -0.604 0.157 "C4'" MC0 16 MC0 "O4'" O3 O 0 1 N N N 12.437 -0.218 5.694 -4.381 -1.407 -0.306 "O4'" MC0 17 MC0 "C5'" C10 C 0 1 N N N 12.387 -2.618 5.649 -5.016 0.405 1.206 "C5'" MC0 18 MC0 "O5'" O4 O 0 1 N N N 12.633 -2.490 4.222 -4.201 1.397 0.579 "O5'" MC0 19 MC0 P1 P1 P 0 1 N N N 12.551 -3.697 3.171 -3.531 2.619 1.386 P1 MC0 20 MC0 O11 O5 O 0 1 N N N 11.691 -3.323 1.998 -2.726 2.087 2.508 O11 MC0 21 MC0 O12 O6 O 0 1 N N N 12.294 -4.966 3.918 -4.687 3.579 1.962 O12 MC0 22 MC0 O6 O7 O 0 1 N N N 14.042 -3.770 2.644 -2.580 3.459 0.394 O6 MC0 23 MC0 P2 P2 P 0 1 N N N 15.214 -4.107 3.666 -1.361 4.486 0.618 P2 MC0 24 MC0 O21 O8 O 0 1 N N N 14.751 -3.959 5.071 -1.937 5.903 1.120 O21 MC0 25 MC0 O22 O9 O 0 1 N N N 15.867 -5.395 3.291 -0.437 3.940 1.638 O22 MC0 26 MC0 O7 O10 O 0 1 N N N 16.262 -2.974 3.195 -0.569 4.689 -0.769 O7 MC0 27 MC0 CPB C11 C 0 1 N N N 16.089 -1.595 3.647 0.628 5.462 -0.876 CPB MC0 28 MC0 CPA C12 C 0 1 N N N 17.510 -1.073 3.781 1.116 5.449 -2.326 CPA MC0 29 MC0 CP7 C13 C 0 1 N N R 18.199 -1.139 2.421 2.398 6.276 -2.440 CP7 MC0 30 MC0 CP9 C14 C 0 1 N N N 18.311 -1.982 4.716 1.399 4.008 -2.755 CP9 MC0 31 MC0 CP8 C15 C 0 1 N N N 17.467 0.342 4.345 0.039 6.049 -3.232 CP8 MC0 32 MC0 OP3 O11 O 0 1 N N N 17.497 -0.538 1.390 2.106 7.648 -2.167 OP3 MC0 33 MC0 CP6 C16 C 0 1 N N N 19.612 -0.614 2.411 3.412 5.771 -1.447 CP6 MC0 34 MC0 OP2 O12 O 0 1 N N N 20.540 -1.323 2.819 3.697 6.441 -0.476 OP2 MC0 35 MC0 NP2 N6 N 0 1 N N N 19.835 0.612 1.992 4.003 4.575 -1.636 NP2 MC0 36 MC0 CP5 C17 C 0 1 N N N 21.171 1.208 1.841 4.910 4.036 -0.619 CP5 MC0 37 MC0 CP4 C18 C 0 1 N N N 21.818 1.003 0.480 5.440 2.676 -1.077 CP4 MC0 38 MC0 CP3 C19 C 0 1 N N N 21.148 1.820 -0.608 6.373 2.122 -0.031 CP3 MC0 39 MC0 OP1 O13 O 0 1 N N N 20.064 2.353 -0.396 6.592 2.753 0.982 OP1 MC0 40 MC0 NP1 N7 N 0 1 N N N 21.717 1.856 -1.808 6.964 0.926 -0.221 NP1 MC0 41 MC0 CP2 C20 C 0 1 N N N 21.210 2.614 -2.943 7.871 0.387 0.797 CP2 MC0 42 MC0 CP1 C21 C 0 1 N N N 21.765 4.023 -3.022 8.401 -0.972 0.338 CP1 MC0 43 MC0 P3 P3 P 0 1 N N N 8.190 -1.461 6.999 -8.920 -0.998 1.663 P3 MC0 44 MC0 O31 O14 O 0 1 N N N 7.220 -0.282 7.217 -10.286 -0.461 1.001 O31 MC0 45 MC0 O32 O15 O 0 1 N N N 8.688 -2.105 8.299 -9.205 -2.384 2.431 O32 MC0 46 MC0 O33 O16 O 0 1 N N N 7.794 -2.478 5.934 -8.413 0.004 2.627 O33 MC0 47 MC0 S S1 S 0 1 N N N 23.562 3.945 -3.332 9.521 -1.638 1.595 S MC0 48 MC0 CS1 C22 C 0 1 N N N 24.147 5.566 -3.009 9.957 -3.117 0.852 CS1 MC0 49 MC0 OS1 O17 O 0 1 N N N 23.465 6.485 -2.636 9.498 -3.409 -0.233 OS1 MC0 50 MC0 CS2 C23 C 0 1 N N S 25.654 5.629 -3.208 10.910 -4.057 1.545 CS2 MC0 51 MC0 CS3 C24 C 0 1 N N N 26.080 4.679 -4.321 10.320 -4.479 2.892 CS3 MC0 52 MC0 CS4 C25 C 0 1 N N N 26.253 6.972 -3.642 11.126 -5.276 0.686 CS4 MC0 53 MC0 OS4 O18 O 0 1 N N N 26.652 6.957 -4.815 10.564 -5.373 -0.379 OS4 MC0 54 MC0 OS5 O19 O 0 1 N N N 26.359 7.944 -2.821 11.943 -6.256 1.105 OS5 MC0 55 MC0 H1 H1 H 0 1 N N N 13.208 -0.470 2.879 -2.586 -3.109 0.613 H1 MC0 56 MC0 H2 H2 H 0 1 N N N 12.250 5.639 4.454 -5.310 -6.604 -4.156 H2 MC0 57 MC0 H3 H3 H 0 1 N N N 14.757 5.177 0.970 -0.956 -7.260 -1.245 H3 MC0 58 MC0 H4 H4 H 0 1 N N N 15.532 3.763 1.230 -1.453 -8.330 -2.442 H4 MC0 59 MC0 H5 H5 H 0 1 N N N 11.121 1.384 5.576 -5.372 -2.382 -1.867 H5 MC0 60 MC0 H6 H6 H 0 1 N N N 11.005 -0.874 3.502 -5.798 -3.688 0.828 H6 MC0 61 MC0 H7 H7 H 0 1 N N N 8.790 -0.184 3.530 -7.084 -4.251 -1.133 H7 MC0 62 MC0 H8 H8 H 0 1 N N N 9.861 -2.188 5.181 -6.308 -1.687 1.862 H8 MC0 63 MC0 H9 H9 H 0 1 N N N 11.584 -1.414 7.212 -5.959 -0.088 -0.680 H9 MC0 64 MC0 H10 H10 H 0 1 N N N 11.770 -3.508 5.841 -5.881 0.883 1.666 H10 MC0 65 MC0 H11 H11 H 0 1 N N N 13.344 -2.713 6.184 -4.437 -0.111 1.971 H11 MC0 66 MC0 H12 H12 H 0 1 N N N 11.556 -5.420 3.528 -5.255 3.965 1.281 H12 MC0 67 MC0 H13 H13 H 0 1 N N N 14.949 -4.752 5.555 -2.551 6.320 0.500 H13 MC0 68 MC0 H14 H14 H 0 1 N N N 15.525 -1.008 2.907 0.426 6.489 -0.570 H14 MC0 69 MC0 H15 H15 H 0 1 N N N 15.567 -1.563 4.615 1.395 5.035 -0.230 H15 MC0 70 MC0 H16 H16 H 0 1 N N N 18.276 -2.210 2.181 2.801 6.185 -3.449 H16 MC0 71 MC0 H17 H17 H 0 1 N N N 17.855 -1.972 5.717 0.468 3.442 -2.764 H17 MC0 72 MC0 H18 H18 H 0 1 N N N 18.307 -3.009 4.322 1.836 4.005 -3.754 H18 MC0 73 MC0 H19 H19 H 0 1 N N N 19.347 -1.619 4.781 2.096 3.550 -2.053 H19 MC0 74 MC0 H20 H20 H 0 1 N N N 16.962 0.333 5.322 -0.249 7.030 -2.854 H20 MC0 75 MC0 H21 H21 H 0 1 N N N 18.493 0.720 4.466 0.431 6.150 -4.244 H21 MC0 76 MC0 H22 H22 H 0 1 N N N 16.915 0.996 3.653 -0.832 5.394 -3.244 H22 MC0 77 MC0 H23 H23 H 0 1 N N N 16.603 -0.860 1.385 1.743 7.804 -1.284 H23 MC0 78 MC0 H24 H24 H 0 1 N N N 19.043 1.177 1.760 3.829 4.070 -2.446 H24 MC0 79 MC0 H25 H25 H 0 1 N N N 21.830 0.765 2.602 5.745 4.722 -0.476 H25 MC0 80 MC0 H26 H26 H 0 1 N N N 21.083 2.290 2.017 4.372 3.918 0.322 H26 MC0 81 MC0 H27 H27 H 0 1 N N N 21.751 -0.062 0.214 4.606 1.990 -1.220 H27 MC0 82 MC0 H28 H28 H 0 1 N N N 22.875 1.299 0.543 5.979 2.794 -2.018 H28 MC0 83 MC0 H29 H29 H 0 1 N N N 22.553 1.324 -1.941 6.789 0.421 -1.030 H29 MC0 84 MC0 H30 H30 H 0 1 N N N 20.115 2.675 -2.861 8.705 1.074 0.939 H30 MC0 85 MC0 H31 H31 H 0 1 N N N 21.479 2.081 -3.867 7.332 0.269 1.737 H31 MC0 86 MC0 H32 H32 H 0 1 N N N 21.578 4.546 -2.072 7.567 -1.659 0.195 H32 MC0 87 MC0 H33 H33 H 0 1 N N N 21.274 4.566 -3.843 8.939 -0.854 -0.602 H33 MC0 88 MC0 H34 H34 H 0 1 N N N 6.481 -0.366 6.626 -10.994 -0.294 1.639 H34 MC0 89 MC0 H35 H35 H 0 1 N N N 8.663 -3.051 8.214 -9.540 -3.088 1.859 H35 MC0 90 MC0 H36 H36 H 0 1 N N N 26.144 5.316 -2.274 11.863 -3.553 1.707 H36 MC0 91 MC0 H37 H37 H 0 1 N N N 25.698 3.670 -4.109 11.010 -5.159 3.393 H37 MC0 92 MC0 H38 H38 H 0 1 N N N 25.672 5.031 -5.280 10.164 -3.597 3.513 H38 MC0 93 MC0 H39 H39 H 0 1 N N N 27.178 4.651 -4.378 9.367 -4.983 2.730 H39 MC0 94 MC0 H40 H40 H 0 1 N N N 26.797 8.672 -3.246 12.050 -7.018 0.520 H40 MC0 95 # # 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 MC0 OS4 CS4 DOUB N N 1 MC0 CS3 CS2 SING N N 2 MC0 CS4 CS2 SING N N 3 MC0 CS4 OS5 SING N N 4 MC0 S CP1 SING N N 5 MC0 S CS1 SING N N 6 MC0 CS2 CS1 SING N N 7 MC0 CP1 CP2 SING N N 8 MC0 CS1 OS1 DOUB N N 9 MC0 CP2 NP1 SING N N 10 MC0 NP1 CP3 SING N N 11 MC0 CP3 OP1 DOUB N N 12 MC0 CP3 CP4 SING N N 13 MC0 CP4 CP5 SING N N 14 MC0 N6 C6 SING N N 15 MC0 OP3 CP7 SING N N 16 MC0 CP5 NP2 SING N N 17 MC0 NP2 CP6 SING N N 18 MC0 O11 P1 DOUB N N 19 MC0 N7 C5 SING Y N 20 MC0 N7 C8 DOUB Y N 21 MC0 C6 C5 DOUB Y N 22 MC0 C6 N1 SING Y N 23 MC0 CP6 CP7 SING N N 24 MC0 CP6 OP2 DOUB N N 25 MC0 CP7 CPA SING N N 26 MC0 C5 C4 SING Y N 27 MC0 O6 P1 SING N N 28 MC0 O6 P2 SING N N 29 MC0 N1 C2 DOUB Y N 30 MC0 C8 N9 SING Y N 31 MC0 P1 O12 SING N N 32 MC0 P1 "O5'" SING N N 33 MC0 O7 CPB SING N N 34 MC0 O7 P2 SING N N 35 MC0 O22 P2 DOUB N N 36 MC0 CPB CPA SING N N 37 MC0 P2 O21 SING N N 38 MC0 C4 N9 SING Y N 39 MC0 C4 N3 DOUB Y N 40 MC0 CPA CP8 SING N N 41 MC0 CPA CP9 SING N N 42 MC0 "O2'" "C2'" SING N N 43 MC0 N9 "C1'" SING N N 44 MC0 C2 N3 SING Y N 45 MC0 "O5'" "C5'" SING N N 46 MC0 "C2'" "C1'" SING N N 47 MC0 "C2'" "C3'" SING N N 48 MC0 "C1'" "O4'" SING N N 49 MC0 "C3'" "C4'" SING N N 50 MC0 "C3'" "O3'" SING N N 51 MC0 "C5'" "C4'" SING N N 52 MC0 "O4'" "C4'" SING N N 53 MC0 O33 P3 DOUB N N 54 MC0 "O3'" P3 SING N N 55 MC0 P3 O31 SING N N 56 MC0 P3 O32 SING N N 57 MC0 C8 H1 SING N N 58 MC0 C2 H2 SING N N 59 MC0 N6 H3 SING N N 60 MC0 N6 H4 SING N N 61 MC0 "C1'" H5 SING N N 62 MC0 "C2'" H6 SING N N 63 MC0 "O2'" H7 SING N N 64 MC0 "C3'" H8 SING N N 65 MC0 "C4'" H9 SING N N 66 MC0 "C5'" H10 SING N N 67 MC0 "C5'" H11 SING N N 68 MC0 O12 H12 SING N N 69 MC0 O21 H13 SING N N 70 MC0 CPB H14 SING N N 71 MC0 CPB H15 SING N N 72 MC0 CP7 H16 SING N N 73 MC0 CP9 H17 SING N N 74 MC0 CP9 H18 SING N N 75 MC0 CP9 H19 SING N N 76 MC0 CP8 H20 SING N N 77 MC0 CP8 H21 SING N N 78 MC0 CP8 H22 SING N N 79 MC0 OP3 H23 SING N N 80 MC0 NP2 H24 SING N N 81 MC0 CP5 H25 SING N N 82 MC0 CP5 H26 SING N N 83 MC0 CP4 H27 SING N N 84 MC0 CP4 H28 SING N N 85 MC0 NP1 H29 SING N N 86 MC0 CP2 H30 SING N N 87 MC0 CP2 H31 SING N N 88 MC0 CP1 H32 SING N N 89 MC0 CP1 H33 SING N N 90 MC0 O31 H34 SING N N 91 MC0 O32 H35 SING N N 92 MC0 CS2 H36 SING N N 93 MC0 CS3 H37 SING N N 94 MC0 CS3 H38 SING N N 95 MC0 CS3 H39 SING N N 96 MC0 OS5 H40 SING N N 97 # # 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 MC0 SMILES ACDLabs 12.01 "c3n(C1OC(C(C1O)OP(O)(O)=O)COP(O)(=O)OP(O)(=O)OCC(C)(C)C(O)C(=O)NCCC(=O)NCCSC(=O)C(C)C(O)=O)c2ncnc(c2n3)N" MC0 InChI InChI 1.03 "InChI=1S/C25H40N7O19P3S/c1-12(23(37)38)24(39)55-7-6-27-14(33)4-5-28-21(36)18(35)25(2,3)9-48-54(45,46)51-53(43,44)47-8-13-17(50-52(40,41)42)16(34)22(49-13)32-11-31-15-19(26)29-10-30-20(15)32/h10-13,16-18,22,34-35H,4-9H2,1-3H3,(H,27,33)(H,28,36)(H,37,38)(H,43,44)(H,45,46)(H2,26,29,30)(H2,40,41,42)/t12-,13+,16+,17+,18-,22+/m0/s1" MC0 InChIKey InChI 1.03 MZFOKIKEPGUZEN-IBNUZSNCSA-N MC0 SMILES_CANONICAL CACTVS 3.385 "C[C@@H](C(O)=O)C(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(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" MC0 SMILES CACTVS 3.385 "C[CH](C(O)=O)C(=O)SCCNC(=O)CCNC(=O)[CH](O)C(C)(C)CO[P](O)(=O)O[P](O)(=O)OC[CH]1O[CH]([CH](O)[CH]1O[P](O)(O)=O)n2cnc3c(N)ncnc23" MC0 SMILES_CANONICAL "OpenEye OEToolkits" 2.0.7 "C[C@@H](C(=O)O)C(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)n2cnc3c2ncnc3N)O)OP(=O)(O)O)O" MC0 SMILES "OpenEye OEToolkits" 2.0.7 "CC(C(=O)O)C(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)n2cnc3c2ncnc3N)O)OP(=O)(O)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 MC0 "SYSTEMATIC NAME" ACDLabs 12.01 "(3S,5R,9R,20S)-1-[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]-3,5,9-trihydroxy-8,8,20-trimethyl-10,14,19-trioxo-2,4,6-trioxa-18-thia-11,15-diaza-3,5-diphosphahenicosan-21-oic acid 3,5-dioxide (non-preferred name)" MC0 "SYSTEMATIC NAME" "OpenEye OEToolkits" 2.0.7 "(2~{S})-3-[2-[3-[[(2~{R})-4-[[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-4-oxidanyl-3-phosphonooxy-oxolan-2-yl]methoxy-oxidanyl-phosphoryl]oxy-oxidanyl-phosphoryl]oxy-3,3-dimethyl-2-oxidanyl-butanoyl]amino]propanoylamino]ethylsulfanyl]-2-methyl-3-oxidanylidene-propanoic acid" # # loop_ _pdbx_chem_comp_audit.comp_id _pdbx_chem_comp_audit.action_type _pdbx_chem_comp_audit.date _pdbx_chem_comp_audit.processing_site MC0 "Create component" 2020-06-11 RCSB MC0 "Initial release" 2020-07-08 RCSB MC0 "Modify synonyms" 2021-03-13 RCSB # _pdbx_chem_comp_synonyms.ordinal 1 _pdbx_chem_comp_synonyms.comp_id MC0 _pdbx_chem_comp_synonyms.name "(3S,5R,9R,20S)-1-[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]-3,5,9-trihydroxy-8,8,20-trimethyl-10,14,19-trioxo-2,4,6-trioxa-18-thia-11,15-diaza-3,5-diphosphahenicosan-21-oic acid 3,5-dioxide (non-preferred name)" _pdbx_chem_comp_synonyms.provenance PDB _pdbx_chem_comp_synonyms.type ? ##