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| PDB ID: 3sn8 Macromolecule: 3C-LIKE PROTEINASE Source Organism: SARSr-CoV Gene names: - UniProt ID: P0C6U8 |
SIMILAR PATTERN OF AMINO ACIDS MAPPED TO PDBID '3sn8'
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. | 5X66_B_MTXB402_1 (THYMIDYLATE SYNTHASE) | Methotrexate | 5 / 11 | PHE A 219ILE A 281LEU A 272GLY A 275ASN A 277 | 1.60A | 20.85 | 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. | 4A83_A_DXCA1161_0 (MAJOR POLLENALLERGEN BET V 1-A) | Deoxycholic Acid | 5 / 12 | GLY A 183PHE A 185LYS A 180TYR A 161LEU A 167 | 1.36A | 19.54 | 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. | 5X66_A_MTXA402_1 (THYMIDYLATE SYNTHASE) | Methotrexate | 5 / 12 | PHE A 219ILE A 281LEU A 272GLY A 275ASN A 277 | 1.57A | 20.85 | 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. | 3MG0_H_BO2H1400_1 (PROTEASOME COMPONENTPUP1PROTEASOME COMPONENTPUP3) | Bortezomib | 5 / 11 | THR A 135ALA A 173GLY A 174THR A 175CYH A 160 | 1.50A | 19.4122.44 | 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. | 2F16_H_BO2H1400_1 (PROTEASOME COMPONENTPUP1PROTEASOME COMPONENTPUP3) | Bortezomib | 5 / 11 | THR A 135ALA A 173GLY A 174THR A 175CYH A 160 | 1.54A | 19.4122.44 | 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. | 3DAU_A_MTXA201_2 (DIHYDROFOLATEREDUCTASE) | Methotrexate | 3 / 3 | SER A 62ILE A 43THR A 26 | 0.96A | 18.39 | 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_A_QI9A602_0 (CYTOCHROME P450 2D6) | Quinine | 5 / 9 | LEU A 27THR A 35VAL A 91VAL A 68PHE A 66 | 1.67A | 22.34 | 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. | 3MG0_V_BO2V1401_1 (PROTEASOME COMPONENTPUP1PROTEASOME COMPONENTPUP3) | Bortezomib | 5 / 11 | THR A 135ALA A 173GLY A 174THR A 175CYH A 160 | 1.52A | 19.4122.44 | 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. | 1V55_C_CHDC3271_0 (CYTOCHROME C OXIDASEPOLYPEPTIDE IIICYTOCHROME C OXIDASEPOLYPEPTIDEVIIA-HEART) | Cholic Acid | 4 / 7 | LYS A 269LEU A 268LEU A 208PHE A 219 | 1.42A | 21.8111.44 | 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. | 3V3N_B_MIYB2001_1 (TETX2 PROTEIN) | Minocycline | 4 / 8 | ARG A 279PHE A 219GLY A 283ASN A 214 | 1.14A | 23.12 | 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. | 5HNX_B_TA1B902_1 (TUBULIN BETA-2BCHAIN) | Paclitaxel | 5 / 12 | VAL A 91ASP A 92LEU A 87LEU A 27THR A 26 | 1.61A | 20.86 | 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_C_QI9C602_0 (CYTOCHROME P450 2D6) | Quinine | 5 / 9 | LEU A 27THR A 35VAL A 91VAL A 68PHE A 66 | 1.69A | 22.34 | 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. | 3G2O_A_SAMA500_1 (PCZA361.24) | S-Adenosylmethionine | 3 / 3 | ARG A 279GLU A 270ASP A 263 | 1.26A | 22.29 | 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. | 5BXN_V_BO2V301_1 (PROTEASOME SUBUNITBETA TYPE-2PROTEASOME SUBUNITBETA TYPE-3) | Bortezomib | 5 / 11 | THR A 135ALA A 173GLY A 174THR A 175CYH A 160 | 1.49A | 20.1322.80 | 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. | 5NOO_C_D16C402_1 (THYMIDYLATE SYNTHASE) | Raltitrexed | 4 / 6 | TYR A 54ASP A 176GLY A 179TYR A 182 | 1.49A | 21.33 | 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. | 5FXT_A_0LAA1376_1 (DNA POLYMERASE IIISUBUNIT BETA) | Carprofen | 4 / 7 | LEU A 27THR A 25ILE A 43MET A 49 | 1.23A | 21.26 | 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. | 5DWK_C_ACTC207_0 (DIACYLGLYCEROLKINASE) | Acetic acid | 4 / 5 | GLU A 290ALA A 129ASN A 203GLU A 288 | 1.78A | 18.78 | 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. | 3V3O_B_T1CB405_1 (TETX2 PROTEIN) | Tigecycline | 5 / 12 | ARG A 279PHE A 219ASN A 277GLY A 283ASN A 214 | 1.50A | 23.12 | 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. | 5BXN_H_BO2H301_1 (PROTEASOME SUBUNITBETA TYPE-2PROTEASOME SUBUNITBETA TYPE-3) | Bortezomib | 5 / 11 | THR A 135ALA A 173GLY A 174THR A 175CYH A 160 | 1.52A | 20.1322.80 | None |