Ligand ID: TMG Drugbank ID: DB00730(Thiabendazole) Indication:For the treatment of strongyloidiasis (threadworm), cutaneous larva migrans (creeping eruption), visceral larva migrans, and trichinosis. |
DrReposER ID / Desc. | Hit PDBID |
Hit Macromolecule |
Res. Matches |
View | Interface | RMSD | Seq. Identity (%) |
HETATM | Dock | |
---|---|---|---|---|---|---|---|---|---|---|
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 2ajf | ACE2 (Homosapiens) | 4 / 8 | ILE B 407MET B 408SER B 411ILE B 544 | 1.57A | 17.7512.73 | None | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 2fe8 | REPLICASEPOLYPROTEIN 1AB (SARSr-CoV) | 4 / 8 | HIS C 276ILE C 286SER C 104ILE C 105 | 1.55A | 22.5616.67 | None | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 2jzf | REPLICASEPOLYPROTEIN 1AB (SARSr-CoV) | 5 / 8 | PRO A 548HIS A 613ILE A 608MET A 624ILE A 593 | 1.73A | 20.4322.22 | None | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 2liz | 3C-LIKE PROTEINASE (SARSr-CoV) | 4 / 8 | ILE A 286TRP A 207SER A 284ILE A 281 | 1.50A | 21.1221.28 | None | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 2rhb | URIDYLATE-SPECIFICENDORIBONUCLEASE (SARSr-CoV) | 4 / 8 | PRO E 270ILE E 269TRP F 58ILE F 42 | 1.73A | 21.4718.84 | None | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 2wct | NSP3 (SARSr-CoV) | 4 / 8 | ILE D 593MET D 624SER D 626ARG D 628 | 1.50A | 22.1122.82 | None | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 3bgf | F26G19 FABSPIKE PROTEIN S1 (Musmusculus;SARSr-CoV) | 4 / 8 | PRO H 52ILE H 51MET H 34ARG S 426 | 1.69A | 19.1723.96 | None | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 3d0h | ACE2 (Pagumalarvata;Homosapiens;SARSr-CoV) | 4 / 8 | ILE B 407MET B 408SER B 411ILE B 544 | 1.45A | 17.7412.73 | None | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 3e9s | NSP3 (SARSr-CoV) | 4 / 8 | HIS A 276ILE A 286SER A 104ILE A 105 | 1.54A | 22.8715.46 | None | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 3scl | ACE2 (Pagumalarvata;Homosapiens;SARSr-CoV) | 4 / 8 | ILE B 407MET B 408SER B 411ILE B 544 | 1.59A | 17.9112.73 | None | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 4m0w | REPLICASEPOLYPROTEIN 1A (SARSr-CoV) | 4 / 8 | HIS A 276ILE A 286SER A 104ILE A 105 | 1.54A | 22.6917.92 | None | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 4mm3 | PAPAIN-LIKEPROTEINASE (SARSr-CoV) | 4 / 8 | HIS B 276ILE B 286SER B 104ILE B 105 | 1.47A | 22.5615.46 | None | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 5b6o | 3C-LIKE PROTEINASE (SARSr-CoV) | 4 / 8 | ILE B 286TRP B 207SER B 284ILE B 281 | 1.55A | 19.3316.88 | None | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 5e6j | REPLICASEPOLYPROTEIN 1AB (SARSr-CoV) | 4 / 8 | HIS D 276ILE D 286SER D 104ILE D 105 | 1.42A | 22.4615.53 | None | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 5tl7 | REPLICASEPOLYPROTEIN 1AB (SARSr-CoV) | 4 / 8 | HIS B 276ILE B 286SER B 104ILE B 105 | 1.49A | 22.5615.46 | None | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 5x4r | S PROTEIN (MERS-CoV) | 4 / 8 | PRO A 97HIS A 91SER A 299ILE A 300 | 1.48A | 19.9419.59 | None | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 5x5c | S PROTEIN (MERS-CoV) | 4 / 8 | PRO A1167ILE A 985TRP B 960ILE A1180 | 1.43A | 10.517.44 | None | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 5y3q | REPLICASEPOLYPROTEIN 1A (SARSr-CoV) | 4 / 8 | HIS A 276ILE A 286SER A 104ILE A 105 | 1.56A | 22.5615.64 | NA A 404 (-3.7A)None NA A 405 ( 3.9A)None | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 6acg | SPIKE GLYCOPROTEIN (SARSr-CoV) | 4 / 8 | MET C 713SER C 712ILE C1000ARG C1001 | 1.34A | 12.359.83 | None | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 6ack | ACE2 (Homosapiens) | 4 / 8 | ILE D 407MET D 408SER D 411ILE D 544 | 1.40A | 17.7512.73 | None | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 6crz | SPIKEGLYCOPROTEIN,FIBRITIN (SARSr-CoV) | 4 / 8 | ILE A 752MET A 713ILE A1000ARG A1001 | 1.41A | 12.499.84 | None | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 6cs2 | ACE2 (Homosapiens) | 4 / 8 | ILE D 407MET D 408SER D 411ILE D 544 | 1.53A | 17.7512.73 | None | ||
![]() | 1YVM_A_TMGA501_1 (METHIONINEAMINOPEPTIDASE) | 6jyt | HELICASE (SARSr-CoV) | 4 / 7 | TYR B 64TYR B 71CYH B 50HIS B 75 | 1.60A | 17.17 | NoneNone ZN B 702 (-2.1A) ZN B 702 (-3.3A) | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 6m17 | SODIUM-DEPENDENTNEUTRAL AMINO ACIDTRANSPORTER B(0)AT1 (Homosapiens) | 4 / 8 | HIS C 108ILE C 107ILE C 15ARG C 14 | 1.63A | 15.4713.52 | None | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 6nus | NSP12 (SARSr-CoV) | 4 / 8 | PRO A 832ILE A 837TRP A 917ILE A 864 | 1.57A | 14.579.38 | None | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 6vsb | SPIKE GLYCOPROTEIN (SARS-CoV-2) | 4 / 8 | PRO B 897ILE B 896ILE A 714ARG A1107 | 1.68A | 10.868.14 | None | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 6vyb | SPIKE GLYCOPROTEIN (SARS-CoV-2) | 4 / 8 | PRO C 897ILE C 896ILE B 714ARG B1107 | 1.69A | 11.697.94 | None | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 6w9c | PAPAIN-LIKEPROTEINASE (SARS-CoV-2) | 4 / 8 | HIS B 275ILE B 285SER B 103ILE B 104 | 1.48A | 22.1616.04 | None CL B 502 (-4.9A) CL B 502 ( 4.4A)None | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 6w9c | PAPAIN-LIKEPROTEINASE (SARS-CoV-2) | 4 / 8 | HIS A 275ILE A 285SER A 103ILE A 104 | 1.59A | 22.1616.04 | None | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 6woj | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 4 / 8 | PRO A 136HIS A 138ILE A 137SER A 167 | 1.78A | 19.9320.47 | None | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 6woj | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 4 / 8 | PRO D 136HIS D 138ILE D 137SER D 167 | 1.79A | 19.9320.47 | None | ||
![]() | 1YVM_A_TMGA501_1 (METHIONINEAMINOPEPTIDASE) | 6woj | REPLICASEPOLYPROTEIN 1AB (SARS-CoV-2) | 4 / 7 | TYR D 68CYH D 81HIS D 94HIS D 45 | 1.57A | 21.27 | None | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 6wrh | PEPTIDASE C16 (SARS-CoV-2) | 4 / 8 | HIS A 275ILE A 285SER A 103ILE A 104 | 1.55A | 21.8815.67 | None | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 6ywk | NSP3 MACRODOMAIN (SARS-CoV-2) | 4 / 8 | PRO B 136ILE B 137SER B 167ARG B 141 | 1.75A | 19.8521.05 | None | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 7bv1 | NSP12 (SARS-CoV-2) | 4 / 8 | PRO A 832ILE A 837TRP A 916ILE A 864 | 1.60A | 13.809.60 | None | ||
![]() | 3SFE_C_TMGC1_1 (SUCCINATEDEHYDROGENASE[UBIQUINONE]IRON-SULFUR SUBUNIT,MITOCHONDRIALSUCCINATEDEHYDROGENASECYTOCHROME B560SUBUNIT,MITOCHONDRIAL) | 7bv2 | NSP12 (SARS-CoV-2) | 4 / 8 | PRO A 832ILE A 837TRP A 916ILE A 864 | 1.69A | 13.809.60 | None |