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| PDB ID: 2idy Macromolecule: NSP3 Source Organism: SARSr-CoV Gene names: - UniProt ID: P0C6X7 |
SIMILAR PATTERN OF AMINO ACIDS MAPPED TO PDBID '2idy'
1) User may click on the DrReposER ID (the first column) to get information on the binding sites and drug molecule.2) Click View (the second last column) to view matched residues and superposition in the NGL viewer (upper right part).3) User may also click on the Dock (the last column) to get script for molecular docking in UCSF Chimera through AutoDock Vina.| DrReposER ID / Desc. | Drug | Res. Matches |
View | Interface | RMSD | Seq. Identity (%) |
HETATM | Dock | |
|---|---|---|---|---|---|---|---|---|---|
 Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3UNI_B_SALB1345_1 (XANTHINEDEHYDROGENASE/OXIDASE) | Salicylic acid | 5 / 8 | LEU A 28PHE A 88VAL A 63LEU A 80ALA A 86 | 1.73A | 7.47 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4MI4_C_SPMC201_1 (SPERMIDINEN1-ACETYLTRANSFERASE) | Spermine | 4 / 7 | GLU A 50GLU A 97TYR A 89GLU A 112 | 1.80A | 20.30 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 6DK1_C_GM4C301_0 (SIGMA NON-OPIOIDINTRACELLULARRECEPTOR 1) | Pentazocine | 5 / 11 | VAL A 58ALA A 59ASP A 33THR A 65ALA A 61 | 1.66A | 16.74 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4GC9_A_SAMA401_1 (DIMETHYLADENOSINETRANSFERASE 1,MITOCHONDRIAL) | S-Adenosylmethionine | 3 / 3 | GLU A 82ASP A 79ASP A 29 | 1.41A | 15.63 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 6GNF_C_QPSC602_2 (-) | Acarbose | 5 / 12 | VAL A 62ASP A 93ASN A 37ARG A 23GLU A 38 | 1.61A | 13.21 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4CCQ_A_ACTA1317_0 (THIOREDOXINREDUCTASE) | Acetic acid | 3 / 3 | LEU A 80GLU A 82SER A 84 | 1.35A | 19.31 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 2XZ5_B_ACHB1211_0 (SOLUBLEACETYLCHOLINERECEPTOR) | Acetylcholine | 4 / 8 | TYR A 104SER A 106CYH A 105ILE A 24 | 1.50A | 18.52 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3G1U_C_ADNC438_1 (ADENOSYLHOMOCYSTEINASE) | Adenosine | 5 / 12 | LEU A 28ASP A 29LEU A 73LEU A 80PHE A 88 | 1.78A | 16.43 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 2M2P_B_DHIB24_0 (INSULIN B CHAIN) | L-Histidine | 3 / 3 | TYR A 104GLY A 95PHE A 26 | 1.61A | 15.24 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 2QBL_A_CAMA517_0 (CYTOCHROME P450-CAM) | Camphor | 4 / 7 | PHE A 88LEU A 66VAL A 63THR A 65 | 1.39A | 14.54 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 1FO4_A_SALA3005_1 (XANTHINEDEHYDROGENASE) | Salicylic acid | 5 / 9 | LEU A 28PHE A 88VAL A 63LEU A 80ALA A 86 | 1.74A | 7.47 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5ACL_A_SASA1111_1 (MCG) | Sulfasalazine | 4 / 7 | TYR A 19GLU A 46PRO A 2PHE A 99 | 1.18A | 22.66 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5IKR_A_ID8A601_2 (PROSTAGLANDIN G/HSYNTHASE 2) | Mefenamic acid | 3 / 3 | VAL A 35LEU A 90MET A 103 | 1.35A | 12.70 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 1JGS_A_SALA256_1 (MULTIPLE ANTIBIOTICRESISTANCE PROTEINMARR) | Salicylic acid | 4 / 7 | VAL A 57THR A 52LEU A 90VAL A 45 | 1.20A | 20.98 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5IGY_A_ERYA403_1 (MACROLIDE2'-PHOSPHOTRANSFERASE II) | Erythromycin | 4 / 6 | ASP A 33ILE A 24ARG A 102TYR A 104 | 1.72A | 19.10 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3N65_B_ACTB860_0 (NITRIC OXIDESYNTHASE) | Acetic acid | 3 / 3 | GLY A 18TRP A 14VAL A 13 | 1.41A | 14.42 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 2FUM_D_MIXD3539_2 (PROBABLESERINE/THREONINE-PROTEIN KINASE PKNB) | Mitoxantrone | 3 / 3 | VAL A 62VAL A 57ASP A 92 | 0.89A | 16.07 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4TVT_A_ASCA303_0 (THAUMATIN-1) | Vitamin C | 4 / 7 | LEU A 36SER A 41ILE A 24VAL A 22 | 1.51A | 18.01 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3N66_B_ACTB860_0 (NITRIC OXIDESYNTHASE) | Acetic acid | 3 / 3 | GLY A 18TRP A 14VAL A 13 | 1.43A | 14.42 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3S8P_A_SAMA500_0 (HISTONE-LYSINEN-METHYLTRANSFERASESUV420H1) | S-Adenosylmethionine | 5 / 12 | GLY A 95ALA A 94SER A 101ASN A 98PHE A 54 | 1.79A | 18.25 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3VNS_A_DVAA602_0 (NRPS ADENYLATIONPROTEIN CYTC1) | L-Valine | 4 / 7 | PHE A 54PHE A 99GLY A 48THR A 44 | 1.37A | 12.91 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4X1I_B_LOCB502_1 (TUBULIN ALPHA CHAINTUBULIN BETA CHAIN) | Colchicine | 3 / 3 | SER A 84ALA A 59VAL A 58 | 1.14A | 16.36 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3OU6_C_SAMC300_0 (SAM-DEPENDENTMETHYLTRANSFERASE) | S-Adenosylmethionine | 5 / 12 | LEU A 90TYR A 89GLU A 82ALA A 86SER A 106 | 1.69A | 19.23 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4V1F_A_BQ1A1087_0 (F0F1 ATP SYNTHASESUBUNIT C) | Bedaquiline | 3 / 3 | GLU A 53ALA A 55PHE A 54 | 0.77A | 15.38 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3RV5_C_DXCC92_0 (TROPONIN C, SLOWSKELETAL AND CARDIACMUSCLES) | Deoxycholic Acid | 4 / 4 | VAL A 62PHE A 88PHE A 54VAL A 45 | 1.51A | 24.14 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4WNV_D_QI9D602_0 (CYTOCHROME P450 2D6) | Quinine | 4 / 7 | SER A 106THR A 87VAL A 58PHE A 54 | 1.40A | 13.68 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 1RMT_B_ADNB1502_1 (CLASS B ACIDPHOSPHATASE) | Adenosine | 4 / 7 | PHE A 88GLU A 97LEU A 90THR A 87 | 1.59A | 22.75 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5IM2_A_BEZA401_0 (TWIN-ARGININETRANSLOCATIONPATHWAY SIGNAL) | Benzoic Acid | 5 / 12 | VAL A 58LEU A 36LEU A 66VAL A 62PHE A 88 | 1.62A | 17.83 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3N62_B_ACTB860_0 (NITRIC OXIDESYNTHASE) | Acetic acid | 3 / 3 | GLY A 18TRP A 14VAL A 13 | 1.43A | 14.18 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 6EW0_G_TA1G501_1 (TUBULIN BETA CHAIN) | Paclitaxel | 5 / 12 | ALA A 59PHE A 88LEU A 90ARG A 23LEU A 28 | 1.56A | 15.06 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5XIW_B_LOCB504_1 (TUBULIN ALPHA-1BCHAINTUBULIN BETA CHAIN) | Colchicine | 3 / 3 | SER A 84ALA A 59VAL A 58 | 1.34A | 16.36 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 1PK7_B_ADNB1246_1 (PURINE NUCLEOSIDEPHOSPHORYLASE) | Adenosine | 4 / 8 | GLY A 18VAL A 16GLU A 15SER A 47 | 1.11A | 26.90 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4XIW_B_AZMB402_1 (CARBONIC ANHYDRASE,ALPHA TYPE) | Acetazolamide | 5 / 12 | GLN A 67GLU A 82LEU A 73THR A 74VAL A 69 | 1.36A | 15.90 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 1S9Q_A_CHDA459_0 (ESTROGEN-RELATEDRECEPTOR GAMMA) | Cholic Acid | 4 / 6 | ASP A 33LEU A 36VAL A 35TYR A 104 | 1.38A | 17.25 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5VUO_B_ACTB804_0 (NITRIC OXIDESYNTHASE, BRAIN) | Acetic acid | 3 / 3 | GLY A 18TRP A 14VAL A 13 | 1.43A | 14.42 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4NC3_A_ERMA1202_1 (CHIMERA PROTEIN OFHUMAN5-HYDROXYTRYPTAMINERECEPTOR 2B AND E.COLI SOLUBLECYTOCHROME B562) | Ergotamine | 5 / 12 | LEU A 73ASP A 29VAL A 69ALA A 59VAL A 35 | 1.30A | 14.08 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3OU6_D_SAMD300_0 (SAM-DEPENDENTMETHYLTRANSFERASE) | S-Adenosylmethionine | 5 / 12 | LEU A 90TYR A 89GLU A 82ALA A 86SER A 106 | 1.73A | 19.23 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 2QM9_B_TDZB202_1 (FATTY ACID-BINDINGPROTEIN, ADIPOCYTE) | Troglitazone | 5 / 12 | PHE A 88THR A 65ALA A 61ILE A 24CYH A 105 | 1.74A | 23.38 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3G1U_D_ADND438_1 (ADENOSYLHOMOCYSTEINASE) | Adenosine | 5 / 12 | LEU A 36ASP A 29LEU A 73LEU A 80PHE A 88 | 1.44A | 16.43 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5TUD_A_ERMA2001_1 (5-HYDROXYTRYPTAMINERECEPTOR 2B,SOLUBLECYTOCHROME B562CHIMERA) | Ergotamine | 5 / 12 | LEU A 73ASP A 29VAL A 69ALA A 59VAL A 35 | 1.42A | 13.32 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5TZO_B_7V7B201_1 (ENDO-1,4-BETA-XYLANASE A) | Fentanyl | 5 / 12 | LEU A 36SER A 84VAL A 62ALA A 55ALA A 59 | 1.37A | 19.15 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 1TBF_A_VIAA501_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | Sildenafil | 5 / 9 | TYR A 43LEU A 66LEU A 36VAL A 58ALA A 55 | 1.60A | 15.38 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 2XZ5_A_ACHA1211_0 (SOLUBLEACETYLCHOLINERECEPTOR) | Acetylcholine | 4 / 7 | TYR A 104SER A 106CYH A 105ILE A 24 | 1.41A | 18.52 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5EYP_B_LOCB502_1 (TUBULIN ALPHA CHAINTUBULIN BETA CHAIN) | Colchicine | 3 / 3 | SER A 84ALA A 59VAL A 58 | 1.13A | 16.36 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 1Z2B_C_VLBC800_2 (TUBULIN ALPHA CHAIN) | Vinblastine | 4 / 5 | PRO A 2ASN A 21VAL A 13ILE A 3 | 1.57A | 16.59 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5ZMQ_K_PACK1_0 (SERINE PROTEASE NS3PEPTIDEPAC-DLY-DLY-DAR) | Phenylacetic acid | 3 / 3 | ALA A 55VAL A 22TYR A 43 | 1.00A | 21.18 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 6EW0_G_TA1G501_2 (TUBULIN BETA CHAIN) | Paclitaxel | 4 / 6 | LEU A 73LEU A 28THR A 65ARG A 102 | 1.41A | 15.06 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4IMA_D_ADND604_1 (PYRUVATE KINASE) | Adenosine | 3 / 3 | ARG A 23GLU A 38ASN A 37 | 1.33A | 12.62 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 1YAJ_G_BEZG3385_0 (CES1 PROTEIN) | Benzoic Acid | 3 / 3 | SER A 106VAL A 51LEU A 90 | 1.29A | 14.66 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4RYA_A_MTLA501_1 (ABC TRANSPORTERSUBSTRATE BINDINGPROTEIN (SORBITOL)) | Mannitol | 3 / 3 | GLU A 112TYR A 89GLU A 97 | 1.01A | 15.59 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4PD9_A_ADNA501_1 (NUPC FAMILY PROTEIN) | Adenosine | 5 / 12 | ALA A 59VAL A 58TYR A 43LEU A 90ASN A 37 | 1.51A | 13.92 | None | ||
| Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5NWU_A_ACAA18_2 (WTFP-TAG,GP41) | Aminocaproic Acid | 3 / 3 | LEU A 72LEU A 73TRP A 83 | 1.44A | 16.33 | None |