Ligand ID: AOQ Drugbank ID: DB01117(Atovaquone) Indication:For the treatment or prevention of Pneumocystis carinii pneumonia in patients who are intolerant to trimethoprim-sulfamethoxazole (TMP-SMX). Also indicated for the acute oral treatment of mild to moderate PCP in patients who are intolerant to TMP-SMX. |
DrReposER ID / Desc. | Hit PDBID |
Hit Macromolecule |
Res. Matches |
View | Interface | RMSD | Seq. Identity (%) |
HETATM | Dock | |
---|---|---|---|---|---|---|---|---|---|---|
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 5rfc | 3C-LIKE PROTEINASE (SARS-CoV-2) | 5 / 12 | GLY A 109ILE A 249PRO A 293LEU A 205ILE A 281 | 1.65A | 16.33 | None | ||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 5rfc | 3C-LIKE PROTEINASE (SARS-CoV-2) | 5 / 12 | GLY A 109ILE A 200ILE A 249PRO A 293LEU A 205 | 1.73A | 16.33 | None | ||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6m17 | RECEPTOR BINDINGDOMAIN (SARS-CoV-2) | 5 / 12 | PHE E 464VAL E 512PRO E 412PHE E 429TYR E 380 | 1.47A | 22.34 | None | ||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6m2n | 3CL PROTEASE (SARS-CoV-2) | 5 / 12 | GLY B 215VAL B 212ILE B 213LEU B 282PHE B 291 | 1.55A | 23.14 | None | ||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6m2n | 3CL PROTEASE (SARS-CoV-2) | 5 / 12 | GLY D 109ILE D 249PRO D 293LEU D 205ILE D 281 | 1.56A | 23.14 | None | ||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6m2n | 3CL PROTEASE (SARS-CoV-2) | 5 / 12 | GLY A 124VAL A 125PHE C 112LEU C 115ILE C 136 | 1.71A | 23.14 | None | ||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6m2n | 3CL PROTEASE (SARS-CoV-2) | 5 / 12 | VAL C 202ILE C 200ILE C 249PHE C 112ILE C 136 | 1.76A | 23.14 | None | ||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6m2n | 3CL PROTEASE (SARS-CoV-2) | 5 / 12 | GLY D 109ILE D 200ILE D 249PRO D 293LEU D 205 | 1.64A | 23.14 | None | ||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6m2n | 3CL PROTEASE (SARS-CoV-2) | 5 / 12 | GLY C 124VAL C 125PHE A 112LEU A 115ILE A 136 | 1.73A | 23.14 | None | ||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6m2n | 3CL PROTEASE (SARS-CoV-2) | 5 / 12 | GLY B 124VAL B 125PHE D 112LEU D 115ILE D 136 | 1.71A | 23.14 | None | ||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6m2n | 3CL PROTEASE (SARS-CoV-2) | 5 / 12 | GLY D 124VAL D 125PHE B 112LEU B 115ILE B 136 | 1.74A | 23.14 | None | ||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6m2n | 3CL PROTEASE (SARS-CoV-2) | 5 / 12 | GLY D 215VAL D 212ILE D 213LEU D 282PHE D 291 | 1.63A | 23.14 | None | ||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6m2n | 3CL PROTEASE (SARS-CoV-2) | 5 / 12 | GLY A 215VAL A 212ILE A 213LEU A 282PHE A 291 | 1.58A | 23.14 | None | ||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6m2n | 3CL PROTEASE (SARS-CoV-2) | 5 / 12 | GLY A 275ILE A 281LEU A 286LEU C 286ILE C 281 | 1.65A | 23.14 | None | ||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6m71 | NSP12 (SARS-CoV-2) | 5 / 12 | VAL A 405ILE A 450LEU A 673TYR A 674LEU A 388 | 1.62A | 16.04 | None | ||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6m71 | NSP12 (SARS-CoV-2) | 5 / 12 | GLY A 670VAL A 405ILE A 450LEU A 673LEU A 388 | 1.59A | 16.04 | None | ||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6vsb | SPIKE GLYCOPROTEIN (SARS-CoV-2) | 5 / 12 | ILE C 818ILE C 726LEU C1063PHE C1052ILE C 882 | 1.41A | 13.81 | None | ||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6vxs | NSP3 (SARS-CoV-2) | 5 / 12 | ILE B 18ILE B 23PRO B 125LEU B 126ILE B 137 | 1.69A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6vxs | NSP3 (SARS-CoV-2) | 5 / 12 | PHE B 116VAL B 151PRO B 125LEU B 127LEU B 140 | 1.68A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6vxs | NSP3 (SARS-CoV-2) | 5 / 12 | ILE A 18ILE A 23PRO A 125LEU A 126ILE A 137 | 1.67A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6vxs | NSP3 (SARS-CoV-2) | 5 / 12 | PHE A 116VAL A 151PRO A 125LEU A 127LEU A 140 | 1.62A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6vyb | SPIKE GLYCOPROTEIN (SARS-CoV-2) | 5 / 12 | GLY B1131VAL B1129ILE B1130PHE C 898LEU C 916 | 1.40A | 14.21 | NAG B1310 (-3.5A)NoneNoneNoneNone | ||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6w41 | SPIKE PROTEIN S1 (SARS-CoV-2) | 5 / 12 | PHE C 515GLY C 431PRO C 384LEU C 387LEU C 368 | 1.23A | 18.87 | None | ||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6w41 | CR3022 FAB LIGHTCHAINSPIKE PROTEIN S1 (Homosapiens;SARS-CoV-2) | 5 / 12 | PHE C 464VAL C 512PRO C 412TYR C 380ILE L 28 | 1.28A | 18.87 | None | ||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6w41 | CR3022 FAB HEAVYCHAINSPIKE PROTEIN S1 (Homosapiens;SARS-CoV-2) | 5 / 12 | GLY C 339VAL C 341ILE C 358LEU C 368ILE H 30 | 1.45A | 18.87 | NAG C 601 ( 4.0A)NoneNoneNoneNone | ||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6w63 | 3C-LIKE PROTEINASE (SARS-CoV-2) | 5 / 12 | GLY A 109ILE A 249PRO A 293LEU A 205ILE A 281 | 1.68A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6w63 | 3C-LIKE PROTEINASE (SARS-CoV-2) | 5 / 12 | GLY A 109ILE A 200ILE A 249PRO A 293LEU A 205 | 1.69A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6w6y | NSP3 (SARS-CoV-2) | 5 / 12 | PHE B 116VAL B 151PRO B 125LEU B 127LEU B 140 | 1.68A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6w6y | NSP3 (SARS-CoV-2) | 5 / 12 | ILE B 18ILE B 23PRO B 125LEU B 126ILE B 137 | 1.77A | 17.18 | None | ||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6w6y | NSP3 (SARS-CoV-2) | 5 / 12 | PHE A 116VAL A 151PRO A 125LEU A 127LEU A 140 | 1.68A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6w6y | NSP3 (SARS-CoV-2) | 5 / 12 | ILE A 18ILE A 23PRO A 125LEU A 126ILE A 137 | 1.75A | NoneAMP A 201 ( 4.0A)NoneAMP A 201 ( 4.4A)None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6wcf | NSP3 (SARS-CoV-2) | 5 / 12 | PHE A 116VAL A 151PRO A 125LEU A 127LEU A 140 | 1.65A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6wen | NSP3 (SARS-CoV-2) | 5 / 12 | ILE A 18ILE A 23PRO A 125LEU A 126ILE A 137 | 1.65A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6wey | NSP3 (SARS-CoV-2) | 5 / 12 | ILE A 222ILE A 227PRO A 329LEU A 330ILE A 341 | 1.68A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6wey | NSP3 (SARS-CoV-2) | 5 / 12 | PHE A 320VAL A 355PRO A 329LEU A 331LEU A 344 | 1.68A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6wiq | NSP8 (SARS-CoV-2) | 5 / 12 | GLY B 113VAL B 115PRO B 183LEU B 117ILE B 156 | 1.58A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6wjt | 2'-O-METHYLTRANSFERASE (SARS-CoV-2) | 5 / 12 | VAL A6894ILE A6866LEU A6924LEU A6892ILE A7079 | 1.74A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6wkp | NUCLEOCAPSID PROTEIN (SARS-CoV-2) | 5 / 12 | PHE C 110GLY C 85VAL C 133ILE C 130LEU C 64 | 1.58A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6wkp | NUCLEOCAPSID PROTEIN (SARS-CoV-2) | 5 / 12 | PHE D 110GLY D 85VAL D 133ILE D 130LEU D 64 | 1.60A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6wkp | NUCLEOCAPSID PROTEIN (SARS-CoV-2) | 5 / 12 | PHE A 110GLY A 85VAL A 133ILE A 130LEU A 64 | 1.55A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6wkp | NUCLEOCAPSID PROTEIN (SARS-CoV-2) | 5 / 12 | PHE B 110GLY B 85VAL B 133ILE B 130LEU B 64 | 1.57A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6wkp | NUCLEOCAPSID PROTEIN (SARS-CoV-2) | 5 / 12 | PHE B 66GLY B 71VAL B 72ILE B 74LEU B 56 | 1.75A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6wlc | URIDYLATE-SPECIFICENDORIBONUCLEASE (SARS-CoV-2) | 5 / 12 | PHE A 214GLY A 254ILE A 253ILE A 236LEU A 298 | 1.76A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6wlc | URIDYLATE-SPECIFICENDORIBONUCLEASE (SARS-CoV-2) | 5 / 12 | PHE B 195GLY B 157ILE B 144PRO B 68LEU B 76 | 1.58A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6woj | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 12 | ILE B 18ILE B 23PRO B 125LEU B 126ILE B 137 | 1.76A | NoneAPR B 201 (-3.8A)NoneNoneNone | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6woj | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 12 | PHE B 116VAL B 151PRO B 125LEU B 127LEU B 140 | 1.66A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6woj | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 12 | PHE D 116VAL D 151PRO D 125LEU D 127LEU D 140 | 1.69A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6woj | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 12 | ILE D 18ILE D 23PRO D 125LEU D 126ILE D 137 | 1.75A | NoneAPR D 201 (-3.8A)NoneNoneNone | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6woj | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 12 | ILE A 18ILE A 23PRO A 125LEU A 126ILE A 137 | 1.69A | NoneAPR A 201 (-4.0A)NoneNoneNone | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6woj | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 12 | PHE A 116VAL A 151PRO A 125LEU A 127LEU A 140 | 1.68A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6wqd | NSP8 (SARS-CoV-2) | 5 / 12 | GLY D 113VAL D 115PRO D 183LEU D 117ILE D 156 | 1.64A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6wqd | NSP8 (SARS-CoV-2) | 5 / 12 | GLY B 113VAL B 115PRO B 183LEU B 117ILE B 156 | 1.60A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6wqd | NSP7NSP8 (SARS-CoV-2) | 5 / 12 | PHE D 92VAL C 16LEU C 60LEU C 55MET C 52 | 1.72A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6wqd | NSP7NSP8 (SARS-CoV-2) | 5 / 12 | PHE B 92VAL A 16LEU A 60LEU A 55MET A 52 | 1.76A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6wqf | 3C-LIKE PROTEINASE (SARS-CoV-2) | 5 / 12 | VAL A 202ILE A 200ILE A 249PHE A 112ILE A 136 | 1.73A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6xez | NSP13 (SARS-CoV-2) | 5 / 12 | GLY E 494ILE E 493ILE E 592PHE E 546ILE E 512 | 1.18A | 21.21 | None | ||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6xez | NSP13 (SARS-CoV-2) | 5 / 12 | GLY E 494ILE E 592PHE E 546LEU E 573ILE E 512 | 1.15A | 21.21 | None | ||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6yb7 | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 12 | GLY A 109ILE A 200ILE A 249PRO A 293LEU A 205 | 1.73A | 16.41 | None | ||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6yb7 | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 12 | GLY A 109ILE A 249PRO A 293LEU A 205ILE A 281 | 1.65A | 16.41 | None | ||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6yhu | REPLICASEPOLYPROTEIN 1A (SARS-CoV-2) | 5 / 12 | GLY B 113VAL B 115PRO B 183LEU B 117ILE B 156 | 1.64A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6yhu | REPLICASEPOLYPROTEIN 1A (SARS-CoV-2) | 5 / 12 | GLY D 113VAL D 115PRO D 183LEU D 117ILE D 156 | 1.63A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6yi3 | NUCLEOPROTEIN (SARS-CoV-2) | 5 / 12 | PHE A 26GLY A 31VAL A 32ILE A 34LEU A 16 | 1.75A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6yi3 | NUCLEOPROTEIN (SARS-CoV-2) | 5 / 12 | PHE A 70GLY A 45VAL A 93ILE A 90LEU A 24 | 1.55A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6yla | LIGHT CHAINSPIKE GLYCOPROTEIN (Homosapiens;SARS-CoV-2) | 5 / 12 | GLY E 381VAL E 382ILE L 34LEU E 513ILE E 410 | 1.73A | NoneDMS L1601 (-4.2A)NoneNoneNone | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6yla | LIGHT CHAINSPIKE GLYCOPROTEIN (Homosapiens;SARS-CoV-2) | 5 / 12 | GLY A 381VAL A 382ILE C 34LEU A 513ILE A 410 | 1.73A | NoneDMS A 905 (-4.3A)NoneNoneNone | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6yla | HEAVY CHAINSPIKE GLYCOPROTEIN (Homosapiens;SARS-CoV-2) | 5 / 12 | GLY E 339VAL E 341ILE E 358LEU E 368ILE H 30 | 1.61A | NAG E 907 ( 4.0A)NoneNoneNoneNone | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6yla | LIGHT CHAINSPIKE GLYCOPROTEIN (Homosapiens;SARS-CoV-2) | 5 / 12 | PHE A 464VAL A 512PRO A 412TYR A 380ILE C 34 | 1.54A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6yla | LIGHT CHAINSPIKE GLYCOPROTEIN (Homosapiens;SARS-CoV-2) | 5 / 12 | GLY A 381VAL A 382ILE C 34LEU A 425LEU A 513 | 1.63A | NoneDMS A 905 (-4.3A)NoneNoneNone | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6yla | LIGHT CHAINSPIKE GLYCOPROTEIN (Homosapiens;SARS-CoV-2) | 5 / 12 | PHE E 464VAL E 512PRO E 412TYR E 380ILE L 34 | 1.38A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6yla | HEAVY CHAINSPIKE GLYCOPROTEIN (Homosapiens;SARS-CoV-2) | 5 / 12 | GLY A 339VAL A 341ILE A 358LEU A 368ILE B 30 | 1.59A | NAG A 904 ( 3.7A)NoneNoneNoneNone | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6ym0 | LIGHT CHAINSPIKE GLYCOPROTEIN (Homosapiens;SARS-CoV-2) | 5 / 12 | PHE E 464VAL E 512PRO E 412TYR E 380ILE L 34 | 1.31A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6ym0 | HEAVY CHAINSPIKE GLYCOPROTEIN (Homosapiens;SARS-CoV-2) | 5 / 12 | GLY E 339VAL E 341ILE E 358LEU E 368ILE H 30 | 1.44A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6ynq | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 12 | GLY A 109ILE A 200ILE A 249PRO A 293LEU A 205 | 1.67A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6ynq | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 12 | GLY A 109ILE A 249PRO A 293LEU A 205ILE A 281 | 1.66A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6yor | IGG L CHAINSPIKE GLYCOPROTEIN (Homosapiens;SARS-CoV-2) | 5 / 12 | PHE E 464VAL E 512PRO E 412TYR E 380ILE L 34 | 1.37A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6yor | IGG H CHAINSPIKE GLYCOPROTEIN (Homosapiens;SARS-CoV-2) | 5 / 12 | GLY A 339VAL A 341ILE A 358LEU A 368ILE B 30 | 1.61A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6yor | SPIKE GLYCOPROTEIN (SARS-CoV-2) | 5 / 12 | PHE A 515GLY A 431PRO A 384LEU A 387LEU A 368 | 1.40A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6yor | IGG L CHAINSPIKE GLYCOPROTEIN (Homosapiens;SARS-CoV-2) | 5 / 12 | PHE A 464VAL A 512PRO A 412TYR A 380ILE C 34 | 1.37A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6yor | IGG H CHAINSPIKE GLYCOPROTEIN (Homosapiens;SARS-CoV-2) | 5 / 12 | GLY E 339VAL E 341ILE E 358LEU E 368ILE H 30 | 1.61A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6yt8 | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 12 | GLY A 109ILE A 249PRO A 293LEU A 205ILE A 281 | 1.64A | PEG A 405 (-3.3A)NoneNoneNoneNone | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6yt8 | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 12 | GLY A 109ILE A 200ILE A 249PRO A 293LEU A 205 | 1.71A | PEG A 405 (-3.3A)PEG A 405 (-4.1A)NoneNoneNone | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6ywk | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | PHE B 116VAL B 151PRO B 125LEU B 127LEU B 140 | 1.67A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6ywk | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | PHE C 116VAL C 151PRO C 125LEU C 127LEU C 140 | 1.72A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6ywk | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | ILE C 18ILE C 23PRO C 125LEU C 126ILE C 137 | 1.69A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6ywk | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | ILE D 18ILE D 23PRO D 125LEU D 126ILE D 137 | 1.70A | NoneEDO D 208 (-4.0A)NoneNoneNone | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6ywk | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | ILE B 18ILE B 23PRO B 125LEU B 126ILE B 137 | 1.68A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6ywk | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | PHE A 116VAL A 151PRO A 125LEU A 127LEU A 140 | 1.68A | NoneNoneNoneEDO A 202 ( 4.8A)None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6ywk | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | ILE A 18ILE A 23PRO A 125LEU A 126ILE A 137 | 1.65A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6ywk | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | PHE D 116VAL D 151PRO D 125LEU D 127LEU D 140 | 1.67A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6ywk | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | ILE E 18ILE E 23PRO E 125LEU E 126ILE E 137 | 1.68A | NoneEDO E 205 (-4.2A)NoneNoneNone | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6ywk | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | PHE E 116VAL E 151PRO E 125LEU E 127LEU E 140 | 1.75A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6ywl | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | ILE E 18ILE E 23PRO E 125LEU E 126ILE E 137 | 1.74A | NoneAPR E 201 (-4.1A)NoneAPR E 201 (-4.7A)None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6ywl | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | PHE A 116VAL A 151PRO A 125LEU A 127LEU A 140 | 1.67A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6ywl | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | PHE B 116VAL B 151PRO B 125LEU B 127LEU B 140 | 1.66A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6ywl | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | ILE B 18ILE B 23PRO B 125LEU B 126ILE B 137 | 1.76A | NoneAPR B 201 (-4.1A)NoneAPR B 201 (-4.7A)None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6ywl | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | PHE D 116VAL D 151PRO D 125LEU D 127LEU D 140 | 1.66A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6ywl | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | PHE C 116VAL C 151PRO C 125LEU C 127LEU C 140 | 1.76A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6ywl | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | PHE E 116VAL E 151PRO E 125LEU E 127LEU E 140 | 1.75A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6ywl | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | ILE A 18ILE A 23PRO A 125LEU A 126ILE A 137 | 1.74A | NoneAPR A 201 (-3.9A)NoneAPR A 201 (-4.8A)None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6ywm | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | PHE C 116VAL C 151PRO C 125LEU C 127LEU C 140 | 1.69A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6ywm | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | PHE A 116VAL A 151PRO A 125LEU A 127LEU A 140 | 1.68A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6ywm | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | ILE C 18ILE C 23PRO C 125LEU C 126ILE C 137 | 1.72A | NoneEDO C 206 (-4.1A)NoneNoneNone | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6ywm | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | ILE A 18ILE A 23PRO A 125LEU A 126ILE A 137 | 1.68A | NoneNoneNoneNoneEDO A 206 (-4.6A) | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6ywm | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | PHE B 116VAL B 151PRO B 125LEU B 127LEU B 140 | 1.68A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 6ywm | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | ILE B 18ILE B 23PRO B 125LEU B 126ILE B 137 | 1.74A | NoneEDO B 202 (-4.0A)NoneNoneNone | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 7btf | NSP12 (SARS-CoV-2) | 5 / 12 | VAL A 405ILE A 450LEU A 673TYR A 674LEU A 388 | 1.61A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 7btf | NSP12 (SARS-CoV-2) | 5 / 12 | GLY A 670VAL A 405ILE A 450LEU A 673LEU A 388 | 1.43A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 7btf | NSP12NSP8 (SARS-CoV-2) | 5 / 12 | VAL B 131ILE B 185ILE A 450TYR A 674LEU A 388 | 1.70A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 7btf | NSP12NSP8 (SARS-CoV-2) | 5 / 12 | VAL A 330ILE B 119PRO B 121MET A 666ILE A 539 | 1.70A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 7bv1 | NSP12 (SARS-CoV-2) | 5 / 12 | VAL A 405ILE A 450LEU A 673TYR A 674LEU A 388 | 1.70A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 7bv1 | NSP12 (SARS-CoV-2) | 5 / 12 | GLY A 670VAL A 405ILE A 450LEU A 673LEU A 388 | 1.49A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 7bv2 | NSP12 (SARS-CoV-2) | 5 / 12 | GLY A 670VAL A 405ILE A 450LEU A 673LEU A 388 | 1.63A | None | |||
![]() | 4PD4_C_AOQC4003_1 (CYTOCHROME B) | 7bv2 | NSP12 (SARS-CoV-2) | 5 / 12 | VAL A 405ILE A 450LEU A 673TYR A 674LEU A 388 | 1.70A | None |