Ligand ID: KTN Drugbank ID: DB01026(Ketoconazole) Indication:For the treatment of the following systemic fungal infections: candidiasis, chronic mucocutaneous candidiasis, oral thrush, candiduria, blastomycosis, coccidioidomycosis, histoplasmosis, chromomycosis, and paracoccidioidomycosis. |
DrReposER ID / Desc. | Hit PDBID |
Hit Macromolecule |
Res. Matches |
View | Interface | RMSD | Seq. Identity (%) |
HETATM | Dock | |
---|---|---|---|---|---|---|---|---|---|---|
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 5rfc | 3C-LIKE PROTEINASE (SARS-CoV-2) | 5 / 12 | ALA A 260LEU A 250VAL A 212ALA A 211THR A 224 | 1.54A | 19.32 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 5rfc | 3C-LIKE PROTEINASE (SARS-CoV-2) | 5 / 12 | PHE A 291ALA A 206GLY A 109THR A 111LEU A 250 | 1.67A | 19.32 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 5rfc | 3C-LIKE PROTEINASE (SARS-CoV-2) | 5 / 12 | ALA A 234THR A 199VAL A 204LEU A 205ALA A 206 | 1.77A | 19.32 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 5rfc | 3C-LIKE PROTEINASE (SARS-CoV-2) | 5 / 12 | PHE A 291ALA A 206ALA A 255THR A 292LEU A 250 | 1.56A | 19.32 | None | ||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 5rfc | 3C-LIKE PROTEINASE (SARS-CoV-2) | 5 / 11 | THR A 225VAL A 233LEU A 272ALA A 234LEU A 205 | 1.69A | 19.60 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 5rfc | 3C-LIKE PROTEINASE (SARS-CoV-2) | 5 / 12 | PHE A 185GLY A 138LEU A 177ARG A 105VAL A 114 | 1.76A | 19.32 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 5rfc | 3C-LIKE PROTEINASE (SARS-CoV-2) | 5 / 12 | THR A 225VAL A 233LEU A 272ALA A 234LEU A 205 | 1.69A | 19.32 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 5rfc | 3C-LIKE PROTEINASE (SARS-CoV-2) | 5 / 12 | GLY A 251LEU A 268VAL A 247LEU A 242THR A 257 | 1.76A | 19.32 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 5rfc | 3C-LIKE PROTEINASE (SARS-CoV-2) | 5 / 12 | ALA A 234THR A 199LEU A 227VAL A 204LEU A 205 | 1.52A | 19.32 | None | ||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 5rfc | 3C-LIKE PROTEINASE (SARS-CoV-2) | 5 / 11 | ALA A 234THR A 199VAL A 204LEU A 205ALA A 206 | 1.78A | 19.60 | None | ||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 5rfc | 3C-LIKE PROTEINASE (SARS-CoV-2) | 5 / 11 | PHE A 291ALA A 206ALA A 255THR A 292LEU A 250 | 1.55A | 19.60 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6lze | VIRAL PROTEASE (SARS-CoV-2) | 5 / 12 | PHE A 291ALA A 206ALA A 255THR A 292LEU A 250 | 1.57A | 18.73 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6lze | VIRAL PROTEASE (SARS-CoV-2) | 5 / 12 | ALA A 234THR A 199LEU A 227VAL A 204LEU A 205 | 1.55A | 18.73 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6lze | VIRAL PROTEASE (SARS-CoV-2) | 5 / 12 | PHE A 223LEU A 287VAL A 212ALA A 211LEU A 271 | 1.60A | 18.73 | None | ||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6lze | VIRAL PROTEASE (SARS-CoV-2) | 5 / 11 | PHE A 291ALA A 206ALA A 255THR A 292LEU A 250 | 1.56A | 21.51 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m0k | VIRAL PROTEASE (SARS-CoV-2) | 5 / 12 | PHE A 223LEU A 287VAL A 212ALA A 211LEU A 271 | 1.60A | 18.69 | None | ||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m0k | VIRAL PROTEASE (SARS-CoV-2) | 5 / 11 | PHE A 291ALA A 206ALA A 255THR A 292LEU A 250 | 1.55A | 21.46 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m0k | VIRAL PROTEASE (SARS-CoV-2) | 5 / 12 | PHE A 291ALA A 206ALA A 255THR A 292LEU A 250 | 1.57A | 18.69 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m0k | VIRAL PROTEASE (SARS-CoV-2) | 5 / 12 | ALA A 260LEU A 250VAL A 212ALA A 211THR A 224 | 1.59A | 18.69 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m0k | VIRAL PROTEASE (SARS-CoV-2) | 5 / 12 | ALA A 234THR A 199LEU A 227VAL A 204LEU A 205 | 1.55A | 18.69 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m2n | 3CL PROTEASE (SARS-CoV-2) | 5 / 12 | ALA B 234THR B 225LEU B 287LEU B 205LEU B 272 | 1.60A | 18.60 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m2n | 3CL PROTEASE (SARS-CoV-2) | 5 / 12 | PHE D 291ALA D 206ALA D 255THR D 292LEU D 250 | 1.50A | 18.60 | None | ||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m2n | 3CL PROTEASE (SARS-CoV-2) | 5 / 11 | PHE A 291ALA A 206ALA A 255THR A 292LEU A 250 | 1.55A | 21.36 | None | ||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m2n | 3CL PROTEASE (SARS-CoV-2) | 5 / 11 | PHE D 291ALA D 206ALA D 255THR D 292LEU D 250 | 1.49A | 21.36 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m2n | 3CL PROTEASE (SARS-CoV-2) | 5 / 12 | ALA B 234THR B 199VAL B 204LEU B 208ALA B 206 | 1.60A | 18.60 | None | ||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m2n | 3CL PROTEASE (SARS-CoV-2) | 5 / 11 | ALA A 234THR A 199VAL A 204LEU A 208ALA A 206 | 1.61A | 21.36 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m2n | 3CL PROTEASE (SARS-CoV-2) | 5 / 12 | PHE C 291ALA C 206ALA C 255THR C 292LEU C 250 | 1.53A | 18.60 | None | ||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m2n | 3CL PROTEASE (SARS-CoV-2) | 5 / 11 | PHE C 291ALA C 206ALA C 255THR C 292LEU C 250 | 1.52A | 21.36 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m2n | 3CL PROTEASE (SARS-CoV-2) | 5 / 12 | ALA B 234THR B 225LEU B 287LEU B 208LEU B 272 | 1.53A | 18.60 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m2n | 3CL PROTEASE (SARS-CoV-2) | 5 / 12 | PHE A 291ALA A 206ALA A 255THR A 292LEU A 250 | 1.56A | 18.60 | None | ||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m2n | 3CL PROTEASE (SARS-CoV-2) | 5 / 11 | ALA B 234THR B 199VAL B 204LEU B 208ALA B 206 | 1.62A | 21.36 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m2n | 3CL PROTEASE (SARS-CoV-2) | 5 / 12 | ALA A 234THR A 199VAL A 204LEU A 208ALA A 206 | 1.59A | 18.60 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m2n | 3CL PROTEASE (SARS-CoV-2) | 5 / 12 | ALA A 234THR A 225LEU A 287LEU A 208LEU A 272 | 1.52A | 18.60 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m2q | 3CL PROTEASE (SARS-CoV-2) | 5 / 12 | ALA A 234THR A 199LEU A 227VAL A 204LEU A 205 | 1.54A | 18.60 | None | ||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m2q | 3CL PROTEASE (SARS-CoV-2) | 5 / 11 | PHE A 291ALA A 206ALA A 255THR A 292LEU A 250 | 1.56A | 21.36 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m2q | 3CL PROTEASE (SARS-CoV-2) | 5 / 12 | PHE A 291ALA A 206ALA A 255THR A 292LEU A 250 | 1.57A | 18.60 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m71 | NSP12 (SARS-CoV-2) | 5 / 12 | TYR A 483VAL A 637LEU A 638ALA A 634THR A 586 | 1.61A | 18.78 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m71 | NSP12 (SARS-CoV-2) | 5 / 12 | ALA A 512TYR A 516THR A 565LEU A 372ALA A 376 | 1.59A | 18.78 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m71 | NSP12 (SARS-CoV-2) | 5 / 12 | PHE A 766GLY A 774VAL A 720LEU A 723LEU A 749 | 1.59A | 18.78 | None | ||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m71 | NSP7NSP8 (SARS-CoV-2) | 5 / 11 | THR C 9LEU C 59ALA D 110THR D 93LEU C 71 | 1.49A | 12.78 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m71 | NSP12 (SARS-CoV-2) | 5 / 12 | LEU A 131VAL A 147LEU A 146THR A 120LEU A 127 | 1.49A | 18.78 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m71 | NSP12 (SARS-CoV-2) | 5 / 12 | ALA A 634THR A 686VAL A 662LEU A 663ALA A 660 | 1.46A | 18.78 | None | ||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m71 | NSP12 (SARS-CoV-2) | 5 / 11 | PHE A 313ALA A 311LEU A 655ALA A 656ALA A 660 | 1.59A | 19.34 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m71 | NSP12 (SARS-CoV-2) | 5 / 12 | ALA A 585GLY A 590THR A 591ALA A 688THR A 582 | 1.42A | 18.78 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m71 | NSP12 (SARS-CoV-2) | 5 / 12 | ALA A 585GLY A 590THR A 591ARG A 750THR A 582 | 1.37A | 18.78 | None | ||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m71 | NSP12 (SARS-CoV-2) | 5 / 11 | THR A 686VAL A 662LEU A 663ALA A 660LEU A 655 | 1.49A | 19.34 | None | ||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m71 | NSP12 (SARS-CoV-2) | 6 / 11 | ALA A 634THR A 686VAL A 662LEU A 663ALA A 660ALA A 656 | 1.58A | 19.34 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m71 | NSP12 (SARS-CoV-2) | 6 / 12 | THR A 686LEU A 351VAL A 662LEU A 663ALA A 660LEU A 655 | 1.60A | 18.78 | None | ||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6m71 | NSP12 (SARS-CoV-2) | 5 / 11 | SER A 518ALA A 490TYR A 521VAL A 495ALA A 685 | 1.47A | 19.34 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6vsb | SPIKE GLYCOPROTEIN (SARS-CoV-2) | 5 / 12 | GLY C 566THR C 573LEU C 533THR C 588LEU C 552 | 1.34A | 16.33 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6vxs | NSP3 (SARS-CoV-2) | 5 / 12 | PHE A 6ALA A 27VAL A 49ALA A 50LEU A 88 | 1.45A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6vxs | NSP3 (SARS-CoV-2) | 5 / 11 | ALA B 50THR A 71VAL B 41LEU B 75ALA B 112 | 1.44A | NoneNoneNoneSO4 B 201 ( 4.4A)None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6vxs | NSP3 (SARS-CoV-2) | 5 / 12 | PHE B 6ALA B 27VAL B 49ALA B 50LEU B 88 | 1.45A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6vxs | NSP3 (SARS-CoV-2) | 5 / 11 | PHE A 6ALA A 27VAL A 49ALA A 50LEU A 88 | 1.48A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6vxs | NSP3 (SARS-CoV-2) | 5 / 11 | PHE B 6ALA B 27VAL B 49ALA B 50LEU B 88 | 1.48A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w41 | CR3022 FAB HEAVYCHAINSPIKE PROTEIN S1 (Homosapiens;SARS-CoV-2) | 5 / 12 | PHE C 377THR C 385VAL H 102LEU H 4ALA H 93 | 1.47A | 20.19 | None | ||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w41 | CR3022 FAB HEAVYCHAINSPIKE PROTEIN S1 (Homosapiens;SARS-CoV-2) | 5 / 11 | PHE C 377THR C 385VAL H 102LEU H 4ALA H 93 | 1.46A | 17.77 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w4b | NSP9 (SARS-CoV-2) | 5 / 12 | ALA B 44GLY A 101LEU B 46ALA B 108LEU B 89 | 1.35A | 14.68 | None | ||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w61 | 2'-O-METHYLTRANSFERASE (SARS-CoV-2) | 5 / 11 | THR A6891VAL A6859LEU A6857ALA A6858LEU A6959 | 1.72A | 16.63 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w61 | 2'-O-METHYLTRANSFERASE (SARS-CoV-2) | 5 / 12 | THR A6891VAL A6859LEU A6857ALA A6858LEU A6959 | 1.70A | 16.63 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w63 | 3C-LIKE PROTEINASE (SARS-CoV-2) | 5 / 12 | PHE A 291ALA A 206ALA A 255THR A 292LEU A 250 | 1.52A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w63 | 3C-LIKE PROTEINASE (SARS-CoV-2) | 5 / 11 | PHE A 291ALA A 206ALA A 255THR A 292LEU A 250 | 1.51A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w63 | 3C-LIKE PROTEINASE (SARS-CoV-2) | 5 / 12 | PHE A 223LEU A 287VAL A 212ALA A 211LEU A 271 | 1.61A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w6y | NSP3 (SARS-CoV-2) | 5 / 11 | THR A 149VAL A 34LEU A 93ALA A 38THR A 146 | 1.71A | 16.87 | NoneNoneNoneAMP A 201 ( 3.9A)None | ||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w6y | NSP3 (SARS-CoV-2) | 5 / 11 | ALA A 112VAL A 151LEU A 122ALA A 154LEU A 127 | 1.79A | 16.87 | NoneNoneNoneAMP A 201 ( 4.5A)None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w6y | NSP3 (SARS-CoV-2) | 5 / 12 | GLY A 8LEU B 126VAL B 165LEU B 164LEU B 153 | 1.63A | 16.21 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w6y | NSP3 (SARS-CoV-2) | 5 / 12 | PHE B 132ALA B 129GLY B 48LEU B 164LEU B 126 | 1.59A | MES B 201 ( 3.4A)NoneNoneNoneNone | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w6y | NSP3 (SARS-CoV-2) | 5 / 12 | LEU A 153VAL A 95LEU A 127ALA A 38THR A 33 | 1.72A | 16.21 | NoneNoneNoneAMP A 201 ( 3.9A)None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w6y | NSP3 (SARS-CoV-2) | 5 / 12 | PHE A 6ALA A 27VAL A 49ALA A 50LEU A 88 | 1.45A | NoneNoneAMP A 201 ( 3.7A)NoneNone | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w6y | NSP3 (SARS-CoV-2) | 5 / 11 | THR B 149VAL B 34LEU B 93ALA B 38THR B 146 | 1.72A | 16.87 | NoneNoneNoneMES B 201 ( 3.4A)None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w6y | NSP3 (SARS-CoV-2) | 5 / 12 | LEU B 153VAL B 95LEU B 127ALA B 38THR B 33 | 1.72A | 16.21 | NoneNoneNoneMES B 201 ( 3.4A)None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w6y | NSP3 (SARS-CoV-2) | 5 / 12 | PHE B 6ALA B 27VAL B 49ALA B 50LEU B 88 | 1.48A | NoneNoneNoneMES B 201 ( 3.7A)None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w6y | NSP3 (SARS-CoV-2) | 5 / 11 | SER B 7ALA B 154VAL B 121LEU B 122ALA B 89 | 1.65A | 16.87 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w6y | NSP3 (SARS-CoV-2) | 5 / 12 | PHE B 132GLY B 48LEU B 140LEU B 160LEU B 126 | 1.79A | 16.21 | MES B 201 ( 3.4A)NoneNoneNoneNone | ||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w6y | NSP3 (SARS-CoV-2) | 5 / 11 | PHE A 6ALA A 27VAL A 49ALA A 50LEU A 88 | 1.48A | NoneNoneAMP A 201 ( 3.7A)NoneNone | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w6y | NSP3 (SARS-CoV-2) | 5 / 11 | PHE B 6ALA B 27VAL B 49ALA B 50LEU B 88 | 1.52A | NoneNoneNoneMES B 201 ( 3.7A)None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w6y | NSP3 (SARS-CoV-2) | 5 / 11 | ALA A 112THR A 146LEU A 122ALA A 154LEU A 127 | 1.79A | 16.87 | NoneNoneNoneAMP A 201 ( 4.5A)None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w6y | NSP3 (SARS-CoV-2) | 5 / 12 | ALA B 112TYR B 113LEU B 75VAL B 36LEU B 93 | 1.75A | 16.21 | None | ||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w6y | NSP3 (SARS-CoV-2) | 5 / 11 | ALA B 112VAL B 151LEU B 122ALA B 154LEU B 127 | 1.79A | 16.87 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w75 | NSP16 (SARS-CoV-2) | 5 / 12 | GLY A7076THR A6856LEU A6959ALA A6960LEU A6924 | 1.67A | 17.05 | None | ||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w75 | NSP16 (SARS-CoV-2) | 5 / 11 | THR C6891VAL C6859LEU C6857ALA C6858LEU C6959 | 1.75A | 17.57 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w75 | NSP16 (SARS-CoV-2) | 5 / 12 | GLY C7076THR C6856LEU C6959ALA C6960LEU C6924 | 1.69A | 17.05 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w75 | NSP16 (SARS-CoV-2) | 5 / 12 | THR C6891VAL C6859LEU C6857ALA C6858LEU C6959 | 1.74A | 17.05 | None | ||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w75 | NSP16 (SARS-CoV-2) | 5 / 11 | ALA C6986THR C6856LEU C7078ALA C6960LEU C7010 | 1.72A | 17.57 | None | ||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w75 | NSP16 (SARS-CoV-2) | 5 / 11 | ALA A6986THR A6856LEU A7078ALA A6960LEU A7010 | 1.71A | 17.57 | None | ||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w9c | PAPAIN-LIKEPROTEINASE (SARS-CoV-2) | 5 / 11 | ALA A 144TYR A 95LEU A 87ALA A 86ALA A 153 | 1.55A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w9c | PAPAIN-LIKEPROTEINASE (SARS-CoV-2) | 5 / 11 | ALA C 144TYR C 95LEU C 87ALA C 86ALA C 153 | 1.51A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w9c | PAPAIN-LIKEPROTEINASE (SARS-CoV-2) | 5 / 11 | ALA C 116LEU C 152ALA C 149ALA C 145LEU C 117 | 1.58A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w9c | PAPAIN-LIKEPROTEINASE (SARS-CoV-2) | 6 / 11 | PHE C 69ALA C 68LEU C 150ALA C 86THR C 75LEU C 80 | 1.73A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w9c | PAPAIN-LIKEPROTEINASE (SARS-CoV-2) | 5 / 11 | ALA B 144TYR B 95LEU B 87ALA B 86ALA B 153 | 1.50A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w9c | PAPAIN-LIKEPROTEINASE (SARS-CoV-2) | 5 / 11 | ALA B 131TYR B 71LEU B 80ALA B 86LEU B 150 | 1.55A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w9c | PAPAIN-LIKEPROTEINASE (SARS-CoV-2) | 5 / 11 | ALA A 131TYR A 71LEU A 80ALA A 86LEU A 150 | 1.59A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w9c | PAPAIN-LIKEPROTEINASE (SARS-CoV-2) | 5 / 11 | PHE A 69ALA A 68ALA A 149ALA A 86LEU A 80 | 1.51A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6w9q | 3C-LIKE PROTEINASEPEPTIDE, NSP9 FUSION (SARS-CoV-2) | 5 / 12 | PHE A -4THR A 35LEU A 106ALA A 30LEU A 9 | 1.47A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6wcf | NSP3 (SARS-CoV-2) | 5 / 11 | PHE A 6ALA A 27VAL A 49ALA A 50LEU A 88 | 1.50A | NoneNoneNoneMES A 201 ( 3.0A)None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6wcf | NSP3 (SARS-CoV-2) | 5 / 12 | PHE A 6ALA A 27VAL A 49ALA A 50LEU A 88 | 1.46A | NoneNoneNoneMES A 201 ( 3.0A)None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6wen | NSP3 (SARS-CoV-2) | 5 / 11 | SER A 139ALA A 124VAL A 49LEU A 53ALA A 50 | 1.57A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6wen | NSP3 (SARS-CoV-2) | 5 / 12 | PHE A 6ALA A 27VAL A 49ALA A 50LEU A 88 | 1.43A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6wen | NSP3 (SARS-CoV-2) | 5 / 11 | PHE A 6ALA A 27VAL A 49ALA A 50LEU A 88 | 1.46A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6wey | NSP3 (SARS-CoV-2) | 5 / 11 | PHE A 210ALA A 231VAL A 253ALA A 254LEU A 292 | 1.58A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6wey | NSP3 (SARS-CoV-2) | 5 / 12 | PHE A 210ALA A 231VAL A 253ALA A 254LEU A 292 | 1.54A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6wiq | NSP7NSP8 (SARS-CoV-2) | 5 / 11 | THR A 9LEU A 59ALA B 110THR B 93LEU A 71 | 1.51A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6wjt | NSP10 (SARS-CoV-2) | 5 / 11 | VAL B4274ALA D4276ALA D4277THR D4292LEU D4284 | 1.62A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6wkq | NSP10 (SARS-CoV-2) | 5 / 11 | VAL B4274ALA D4276ALA D4277THR D4292LEU D4284 | 1.62A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6wnp | 3C-LIKE PROTEINASE (SARS-CoV-2) | 5 / 11 | PHE A 291ALA A 206ALA A 255THR A 292LEU A 250 | 1.53A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6wnp | 3C-LIKE PROTEINASE (SARS-CoV-2) | 5 / 12 | PHE A 291ALA A 206ALA A 255THR A 292LEU A 250 | 1.55A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6wnp | 3C-LIKE PROTEINASE (SARS-CoV-2) | 5 / 12 | ALA A 234THR A 199LEU A 227VAL A 204LEU A 205 | 1.56A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6woj | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 12 | PHE A 6ALA A 27VAL A 49ALA A 50LEU A 88 | 1.50A | NoneNoneAPR A 201 (-3.8A)APR A 201 (-3.4A)None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6woj | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 11 | PHE A 6ALA A 27VAL A 49ALA A 50LEU A 88 | 1.54A | NoneNoneAPR A 201 (-3.8A)APR A 201 (-3.4A)None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6woj | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 12 | PHE D 6ALA D 27VAL D 49ALA D 50LEU D 88 | 1.51A | NoneNoneAPR D 201 (-3.6A)APR D 201 ( 3.7A)None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6woj | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 11 | PHE C 6ALA C 27VAL C 49ALA C 50LEU C 88 | 1.53A | NoneNoneAPR C 201 (-3.8A)APR C 201 (-3.5A)None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6woj | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 12 | PHE B 6ALA B 27VAL B 49ALA B 50LEU B 88 | 1.52A | NoneNoneAPR B 201 (-3.7A)APR B 201 (-3.3A)None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6woj | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 11 | PHE B 6ALA B 27VAL B 49ALA B 50LEU B 88 | 1.56A | NoneNoneAPR B 201 (-3.7A)APR B 201 (-3.3A)None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6woj | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 12 | PHE C 6ALA C 27VAL C 49ALA C 50LEU C 88 | 1.49A | NoneNoneAPR C 201 (-3.8A)APR C 201 (-3.5A)None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6woj | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 11 | PHE D 6ALA D 27VAL D 49ALA D 50LEU D 88 | 1.55A | NoneNoneAPR D 201 (-3.6A)APR D 201 ( 3.7A)None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6wqd | NSP7NSP8 (SARS-CoV-2) | 5 / 12 | THR B 93LEU A 60LEU A 71THR A 9LEU A 56 | 1.61A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6wqf | 3C-LIKE PROTEINASE (SARS-CoV-2) | 5 / 12 | ALA A 234THR A 199LEU A 227VAL A 204LEU A 205 | 1.57A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6wqf | 3C-LIKE PROTEINASE (SARS-CoV-2) | 5 / 11 | PHE A 291ALA A 206ALA A 255THR A 292LEU A 250 | 1.53A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6wqf | 3C-LIKE PROTEINASE (SARS-CoV-2) | 5 / 12 | PHE A 291ALA A 206ALA A 255THR A 292LEU A 250 | 1.54A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6wrh | PEPTIDASE C16 (SARS-CoV-2) | 5 / 11 | THR A 168LEU A 152ALA A 149ALA A 145THR A 115 | 1.56A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6wrh | PEPTIDASE C16 (SARS-CoV-2) | 5 / 11 | SER A 262LEU A 290ALA A 288THR A 119LEU A 101 | 1.58A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6wrh | PEPTIDASE C16 (SARS-CoV-2) | 6 / 11 | PHE A 69ALA A 68ALA A 149ALA A 86THR A 75LEU A 80 | 1.48A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6wrh | PEPTIDASE C16 (SARS-CoV-2) | 5 / 12 | PHE A 69ALA A 68ALA A 149THR A 75LEU A 80 | 1.48A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6wrh | PEPTIDASE C16 (SARS-CoV-2) | 5 / 11 | ALA A 144TYR A 95LEU A 87ALA A 86ALA A 153 | 1.48A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6wrh | PEPTIDASE C16 (SARS-CoV-2) | 5 / 11 | ALA A 131TYR A 71LEU A 80ALA A 86LEU A 150 | 1.56A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6yb7 | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 12 | PHE A 291ALA A 206GLY A 109THR A 111LEU A 250 | 1.67A | 19.32 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6yb7 | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 12 | THR A 225VAL A 233LEU A 272ALA A 234LEU A 205 | 1.73A | 19.32 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6yb7 | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 12 | ALA A 234THR A 199LEU A 227VAL A 204LEU A 205 | 1.52A | 19.32 | None | ||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6yb7 | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 11 | PHE A 291ALA A 206ALA A 255THR A 292LEU A 250 | 1.57A | 19.60 | None | ||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6yb7 | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 11 | ALA A 234THR A 199VAL A 204LEU A 205ALA A 206 | 1.79A | 19.60 | None | ||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6yb7 | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 11 | THR A 225VAL A 233LEU A 272ALA A 234LEU A 205 | 1.73A | 19.60 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6yb7 | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 12 | ALA A 234THR A 199VAL A 204LEU A 205ALA A 206 | 1.78A | 19.32 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6yb7 | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 12 | ALA A 234LEU A 242LEU A 205ALA A 206THR A 198 | 1.80A | 19.32 | NoneNoneNoneNoneDMS A 404 (-3.8A) | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6yb7 | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 12 | PHE A 291ALA A 206ALA A 255THR A 292LEU A 250 | 1.57A | 19.32 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6yb7 | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 12 | GLY A 251LEU A 268VAL A 247LEU A 242THR A 257 | 1.74A | 19.32 | None | ||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6yb7 | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 12 | ALA A 260LEU A 250VAL A 212ALA A 211THR A 224 | 1.54A | 19.32 | None | ||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6yhu | REPLICASEPOLYPROTEIN 1A (SARS-CoV-2) | 5 / 11 | THR D 93LEU C 71ALA C 65THR C 9LEU C 56 | 1.57A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6yhu | REPLICASEPOLYPROTEIN 1A (SARS-CoV-2) | 5 / 12 | THR D 93LEU C 60LEU C 71THR C 9LEU C 56 | 1.58A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6yhu | REPLICASEPOLYPROTEIN 1A (SARS-CoV-2) | 5 / 11 | THR B 93LEU A 71ALA A 65THR A 9LEU A 56 | 1.50A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6yla | HEAVY CHAINSPIKE GLYCOPROTEIN (Homosapiens;SARS-CoV-2) | 5 / 12 | PHE A 377THR A 385VAL B 108LEU B 4ALA B 97 | 1.40A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6yla | HEAVY CHAINSPIKE GLYCOPROTEIN (Homosapiens;SARS-CoV-2) | 5 / 11 | PHE E 377THR E 385VAL H 108LEU H 4ALA H 97 | 1.56A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6yla | HEAVY CHAINSPIKE GLYCOPROTEIN (Homosapiens;SARS-CoV-2) | 5 / 12 | PHE E 377THR E 385VAL H 108LEU H 4ALA H 97 | 1.58A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6yla | HEAVY CHAINSPIKE GLYCOPROTEIN (Homosapiens;SARS-CoV-2) | 5 / 11 | PHE A 377THR A 385VAL B 108LEU B 4ALA B 97 | 1.38A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ym0 | HEAVY CHAINSPIKE GLYCOPROTEIN (Homosapiens;SARS-CoV-2) | 5 / 12 | PHE E 377THR E 385VAL H 108LEU H 4ALA H 97 | 1.45A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ym0 | HEAVY CHAINSPIKE GLYCOPROTEIN (Homosapiens;SARS-CoV-2) | 5 / 11 | PHE E 377THR E 385VAL H 108LEU H 4ALA H 97 | 1.43A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ynq | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 12 | PHE A 291ALA A 206ALA A 255THR A 292LEU A 250 | 1.55A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ynq | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 11 | PHE A 291ALA A 206ALA A 255THR A 292LEU A 250 | 1.55A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ynq | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 12 | ALA A 234THR A 199LEU A 227VAL A 204LEU A 205 | 1.60A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6yor | IGG H CHAINSPIKE GLYCOPROTEIN (Homosapiens;SARS-CoV-2) | 5 / 12 | PHE E 377THR E 385VAL H 108LEU H 4ALA H 97 | 1.58A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6yor | IGG H CHAINSPIKE GLYCOPROTEIN (Homosapiens;SARS-CoV-2) | 5 / 11 | PHE E 377THR E 385VAL H 108LEU H 4ALA H 97 | 1.55A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6yor | IGG H CHAINSPIKE GLYCOPROTEIN (Homosapiens;SARS-CoV-2) | 5 / 12 | PHE A 377THR A 385VAL B 108LEU B 4ALA B 97 | 1.57A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6yor | IGG H CHAINSPIKE GLYCOPROTEIN (Homosapiens;SARS-CoV-2) | 5 / 11 | PHE A 377THR A 385VAL B 108LEU B 4ALA B 97 | 1.55A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6yt8 | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 11 | THR A 225VAL A 233LEU A 272ALA A 234LEU A 205 | 1.61A | NoneNonePEG A 404 (-3.4A)NoneNone | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6yt8 | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 12 | PHE A 291ALA A 206ALA A 255THR A 292LEU A 250 | 1.52A | CL A 406 (-4.4A)NoneNoneNoneNone | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6yt8 | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 12 | THR A 225VAL A 233LEU A 272ALA A 234LEU A 205 | 1.60A | NoneNonePEG A 404 (-3.4A)NoneNone | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6yt8 | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 11 | PHE A 291ALA A 206ALA A 255THR A 292LEU A 250 | 1.51A | CL A 406 (-4.4A)NoneNoneNoneNone | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6yt8 | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 5 / 12 | ALA A 234THR A 199LEU A 227VAL A 204LEU A 205 | 1.60A | NonePEG A 404 (-3.0A)NoneNoneNone | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywk | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | PHE B 6ALA B 27VAL B 49ALA B 50LEU B 88 | 1.47A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywk | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 11 | PHE B 6ALA B 27VAL B 49ALA B 50LEU B 88 | 1.51A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywk | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 11 | PHE C 6ALA C 27VAL C 49ALA C 50LEU C 88 | 1.49A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywk | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 11 | PHE A 6ALA A 27VAL A 49ALA A 50LEU A 88 | 1.51A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywk | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 11 | PHE E 6ALA E 27VAL E 49ALA E 50LEU E 88 | 1.52A | NoneNoneNoneEPE E 202 (-3.1A)None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywk | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 11 | PHE D 6ALA D 27VAL D 49ALA D 50LEU D 88 | 1.50A | NoneNoneEDO D 209 (-4.6A)EDO D 206 (-3.6A)None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywk | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | PHE E 6ALA E 27VAL E 49ALA E 50LEU E 88 | 1.49A | NoneNoneNoneEPE E 202 (-3.1A)None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywk | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | PHE A 6ALA A 27VAL A 49ALA A 50LEU A 88 | 1.47A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywk | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | GLY D 8LEU E 126VAL E 165LEU E 164LEU E 153 | 1.57A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywk | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | PHE C 6ALA C 27VAL C 49ALA C 50LEU C 88 | 1.45A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywk | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 11 | SER E 7ALA E 154VAL E 121LEU E 122ALA E 89 | 1.61A | NoneEDO E 205 (-4.4A)NoneNoneNone | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywk | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | PHE D 6ALA D 27VAL D 49ALA D 50LEU D 88 | 1.46A | NoneNoneEDO D 209 (-4.6A)EDO D 206 (-3.6A)None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywl | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | PHE A 6ALA A 27VAL A 49ALA A 50LEU A 88 | 1.48A | NoneNoneAPR A 201 (-3.7A)APR A 201 (-3.4A)None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywl | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | PHE B 6ALA B 27VAL B 49ALA B 50LEU B 88 | 1.47A | NoneNoneAPR B 201 (-3.7A)APR B 201 (-3.5A)None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywl | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | PHE D 6ALA D 27VAL D 49ALA D 50LEU D 88 | 1.48A | NoneNoneAPR D 201 (-3.7A)APR D 201 (-3.6A)None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywl | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 11 | PHE B 6ALA B 27VAL B 49ALA B 50LEU B 88 | 1.52A | NoneNoneAPR B 201 (-3.7A)APR B 201 (-3.5A)None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywl | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 11 | PHE C 6ALA C 27VAL C 49ALA C 50LEU C 88 | 1.54A | NoneNoneAPR C 201 (-3.6A)APR C 201 (-3.6A)None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywl | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 11 | PHE E 6ALA E 27VAL E 49ALA E 50LEU E 88 | 1.52A | NoneNoneAPR E 201 (-3.7A)APR E 201 (-3.4A)None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywl | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 11 | PHE D 6ALA D 27VAL D 49ALA D 50LEU D 88 | 1.52A | NoneNoneAPR D 201 (-3.7A)APR D 201 (-3.6A)None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywl | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | PHE B 132ALA B 129GLY B 48LEU B 164LEU B 126 | 1.57A | APR B 201 (-3.5A)APR B 201 (-3.6A)APR B 201 (-3.5A)NoneAPR B 201 (-4.7A) | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywl | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | PHE C 6ALA C 27VAL C 49ALA C 50LEU C 88 | 1.49A | NoneNoneAPR C 201 (-3.6A)APR C 201 (-3.6A)None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywl | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | PHE A 132ALA A 129GLY A 48LEU A 164LEU A 126 | 1.59A | APR A 201 (-3.7A)APR A 201 ( 3.7A)APR A 201 (-3.4A)NoneAPR A 201 (-4.8A) | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywl | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | PHE E 6ALA E 27VAL E 49ALA E 50LEU E 88 | 1.48A | NoneNoneAPR E 201 (-3.7A)APR E 201 (-3.4A)None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywl | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | GLY D 8LEU E 126VAL E 165LEU E 164LEU E 153 | 1.58A | NoneAPR E 201 (-4.7A)NoneNoneNone | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywl | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 11 | PHE A 6ALA A 27VAL A 49ALA A 50LEU A 88 | 1.53A | NoneNoneAPR A 201 (-3.7A)APR A 201 (-3.4A)None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywm | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | PHE B 132ALA B 129LEU B 164ALA B 21LEU B 126 | 1.59A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywm | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | PHE A 6ALA A 27VAL A 49ALA A 50LEU A 88 | 1.46A | NoneNoneNoneMES A 201 ( 3.7A)None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywm | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | PHE A 132ALA A 129GLY A 48LEU A 164LEU A 126 | 1.60A | MES A 201 (-3.5A)NoneNoneNoneNone | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywm | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 11 | PHE C 6ALA C 27VAL C 49ALA C 50LEU C 88 | 1.50A | NoneNoneNoneMES C 201 ( 3.8A)None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywm | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | PHE C 6ALA C 27VAL C 49ALA C 50LEU C 88 | 1.46A | NoneNoneNoneMES C 201 ( 3.8A)None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywm | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 11 | PHE B 6ALA B 27VAL B 49ALA B 50LEU B 88 | 1.52A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywm | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 12 | PHE B 6ALA B 27VAL B 49ALA B 50LEU B 88 | 1.49A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 6ywm | NSP3 MACRODOMAIN (SARS-CoV-2) | 5 / 11 | PHE A 6ALA A 27VAL A 49ALA A 50LEU A 88 | 1.49A | NoneNoneNoneMES A 201 ( 3.7A)None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 7bqy | MAIN PROTEASE (SARS-CoV-2) | 5 / 12 | PHE A 291ALA A 206ALA A 255THR A 292LEU A 250 | 1.55A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 7bqy | MAIN PROTEASE (SARS-CoV-2) | 5 / 12 | ALA A 234THR A 199LEU A 227VAL A 204LEU A 205 | 1.57A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 7bqy | MAIN PROTEASE (SARS-CoV-2) | 5 / 11 | PHE A 291ALA A 206ALA A 255THR A 292LEU A 250 | 1.54A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 7btf | NSP12 (SARS-CoV-2) | 5 / 12 | ALA A 634THR A 686VAL A 662LEU A 663ALA A 660 | 1.39A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 7btf | NSP12 (SARS-CoV-2) | 5 / 11 | THR A 540VAL A 662LEU A 663ALA A 690THR A 556 | 1.54A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 7btf | NSP7NSP8 (SARS-CoV-2) | 5 / 11 | THR D 89VAL C 66ALA C 65THR C 9LEU C 56 | 1.33A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 7btf | NSP12 (SARS-CoV-2) | 5 / 11 | PHE A 313ALA A 311LEU A 655ALA A 656ALA A 660 | 1.52A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 7btf | NSP12 (SARS-CoV-2) | 5 / 11 | PHE A 694ALA A 634LEU A 655ALA A 656THR A 680 | 1.60A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 7btf | NSP12 (SARS-CoV-2) | 5 / 11 | ALA A 634THR A 687VAL A 662LEU A 663ALA A 656 | 1.46A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 7btf | NSP12NSP8 (SARS-CoV-2) | 5 / 11 | PHE A 340ALA A 379LEU A 673ALA A 400LEU B 117 | 1.59A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 7btf | NSP12 (SARS-CoV-2) | 5 / 11 | THR A 686VAL A 662LEU A 663ALA A 660LEU A 655 | 1.58A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 7btf | NSP12 (SARS-CoV-2) | 6 / 12 | THR A 686LEU A 351VAL A 662LEU A 663ALA A 660LEU A 655 | 1.64A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 7btf | NSP12NSP8 (SARS-CoV-2) | 5 / 12 | PHE A 340ALA A 379LEU A 673ALA A 400LEU B 117 | 1.59A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 7btf | NSP12 (SARS-CoV-2) | 5 / 12 | ALA A 585GLY A 590THR A 591ALA A 688THR A 582 | 1.54A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 7btf | NSP12 (SARS-CoV-2) | 6 / 11 | ALA A 634THR A 686VAL A 662LEU A 663ALA A 660ALA A 656 | 1.57A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 7btf | NSP12NSP8 (SARS-CoV-2) | 5 / 11 | ALA B 150TYR B 149ALA A 399ALA A 382LEU B 122 | 1.58A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 7btf | NSP12 (SARS-CoV-2) | 5 / 11 | PHE A 571THR A 531VAL A 373LEU A 372ALA A 376 | 1.59A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 7btf | NSP12 (SARS-CoV-2) | 5 / 12 | PHE A 766GLY A 774VAL A 720LEU A 723LEU A 749 | 1.57A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 7btf | NSP12 (SARS-CoV-2) | 5 / 11 | PHE A 694ALA A 690LEU A 655ALA A 656THR A 680 | 1.56A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 7btf | NSP7NSP8 (SARS-CoV-2) | 5 / 12 | THR D 89VAL C 66ALA C 65THR C 9LEU C 56 | 1.31A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 7buy | VIRUS MAIN PROTEASE (SARS-CoV-2) | 5 / 12 | ALA A 260LEU A 250VAL A 212ALA A 211THR A 224 | 1.58A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 7buy | VIRUS MAIN PROTEASE (SARS-CoV-2) | 5 / 12 | PHE A 291ALA A 206ALA A 255THR A 292LEU A 250 | 1.57A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 7buy | VIRUS MAIN PROTEASE (SARS-CoV-2) | 5 / 11 | PHE A 291ALA A 206ALA A 255THR A 292LEU A 250 | 1.56A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 7buy | VIRUS MAIN PROTEASE (SARS-CoV-2) | 5 / 12 | ALA A 234THR A 199LEU A 227VAL A 204LEU A 205 | 1.56A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 7bv1 | NSP12 (SARS-CoV-2) | 6 / 12 | THR A 686LEU A 351VAL A 662LEU A 663ALA A 660LEU A 655 | 1.67A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 7bv1 | NSP12 (SARS-CoV-2) | 5 / 12 | ALA A 634THR A 686VAL A 662LEU A 663ALA A 660 | 1.38A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 7bv1 | NSP12 (SARS-CoV-2) | 5 / 12 | PHE A 694ALA A 690LEU A 655ALA A 656THR A 680 | 1.60A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 7bv1 | NSP12 (SARS-CoV-2) | 5 / 12 | THR A 462LEU A 470VAL A 315ALA A 311LEU A 469 | 1.61A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 7bv1 | NSP12NSP7 (SARS-CoV-2) | 5 / 11 | PHE C 49THR C 9LEU C 17ALA A 443LEU C 35 | 1.62A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 7bv1 | NSP12 (SARS-CoV-2) | 5 / 11 | PHE A 694ALA A 690LEU A 655ALA A 656THR A 680 | 1.58A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 7bv1 | NSP12 (SARS-CoV-2) | 5 / 11 | THR A 686VAL A 662LEU A 663ALA A 660LEU A 655 | 1.59A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 7bv1 | NSP12 (SARS-CoV-2) | 5 / 11 | ALA A 634THR A 687VAL A 662LEU A 663ALA A 656 | 1.53A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 7bv1 | NSP12 (SARS-CoV-2) | 5 / 11 | SER A 236ALA A 43VAL A 704LEU A 707ALA A 706 | 1.30A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 7bv1 | NSP12 (SARS-CoV-2) | 5 / 12 | ALA A 585GLY A 590THR A 591ALA A 688THR A 582 | 1.43A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 7bv1 | NSP12 (SARS-CoV-2) | 6 / 11 | ALA A 634THR A 686VAL A 662LEU A 663ALA A 660ALA A 656 | 1.59A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 7bv1 | NSP12 (SARS-CoV-2) | 5 / 11 | PHE A 313ALA A 311LEU A 655ALA A 656ALA A 660 | 1.58A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 7bv1 | NSP12NSP8 (SARS-CoV-2) | 5 / 12 | PHE A 340ALA A 379LEU A 673ALA A 399LEU B 117 | 1.41A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 7bv2 | NSP12 (SARS-CoV-2) | 5 / 12 | PHE A 766GLY A 774VAL A 720LEU A 723LEU A 749 | 1.54A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 7bv2 | NSP12 (SARS-CoV-2) | 5 / 11 | ALA A 634THR A 686VAL A 662LEU A 663ALA A 656 | 1.32A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 7bv2 | NSP12 (SARS-CoV-2) | 5 / 11 | THR A 686VAL A 662LEU A 663ALA A 660LEU A 655 | 1.49A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 7bv2 | NSP12 (SARS-CoV-2) | 5 / 11 | SER A 236ALA A 43VAL A 704LEU A 707ALA A 706 | 1.37A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 7bv2 | NSP12 (SARS-CoV-2) | 5 / 11 | PHE A 313ALA A 311LEU A 655ALA A 656ALA A 660 | 1.52A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 7bv2 | NSP12NSP8 (SARS-CoV-2) | 5 / 11 | ALA B 150TYR B 149ALA A 399ALA A 382LEU B 122 | 1.48A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 7bv2 | NSP12 (SARS-CoV-2) | 6 / 12 | THR A 686LEU A 351VAL A 662LEU A 663ALA A 660LEU A 655 | 1.56A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 7bv2 | NSP12 (SARS-CoV-2) | 5 / 11 | PHE A 571THR A 531VAL A 373LEU A 372ALA A 376 | 1.58A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 7bv2 | NSP12 (SARS-CoV-2) | 5 / 12 | ALA A 585GLY A 590THR A 591ALA A 688THR A 582 | 1.48A | None A T 13 ( 3.1A)NoneF86 P 102 ( 4.1A)None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 7bv2 | NSP12 (SARS-CoV-2) | 5 / 11 | THR A 686VAL A 662LEU A 663ALA A 656LEU A 636 | 1.60A | None | |||
![]() | 1JIN_A_KTNA801_1 (CYTOCHROME P450107A1) | 7bv2 | NSP12 (SARS-CoV-2) | 5 / 11 | THR A 686VAL A 662LEU A 663ALA A 660ALA A 656 | 1.61A | None | |||
![]() | 1JIP_A_KTNA801_1 (CYTOCHROME P450107A1) | 7bv2 | NSP12 (SARS-CoV-2) | 5 / 12 | PHE A 571THR A 531VAL A 373LEU A 372ALA A 376 | 1.60A | None |