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| PDB ID: 4njl Macromolecule: S PROTEIN Source Organism: MERS-CoV Gene names: - UniProt ID: R9UQ53 |
SIMILAR PATTERN OF AMINO ACIDS MAPPED TO PDBID '4njl'
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. | 2QHF_A_ACTA502_0 (CHORISMATE SYNTHASE) | Acetic acid | 3 / 3 | GLY A1066ASP A1059SER A1064 | 1.42A | 14.93 | 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. | 4XK8_A_PQNA844_1 (PHOTOSYSTEM I P700CHLOROPHYLL AAPOPROTEIN A1) | Phylloquinone | 4 / 7 | PHE A1012SER A1268ALA A1275LEU A1276 | 1.37A | 12.39 | 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. | 2PYM_A_1UNA1001_3 (PROTEASE RETROPEPSIN) | Nelfinavir | 3 / 3 | ASP A1024ASN A1028THR A1257 | 1.25A | 19.83 | 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. | 1I9G_A_SAMA301_0 (HYPOTHETICAL PROTEINRV2118C) | S-Adenosylmethionine | 5 / 12 | ILE A1047GLY A1052ALA A1046ASP A1059LEU A1058 | 1.21A | 17.27 | NoneNonePGE A2001 ( 4.7A)NoneNone | ||
| 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. | 3NU4_B_478B401_2 (PROTEASE) | Amprenavir | 5 / 9 | LEU A1058ASP A1059GLY A1066ILE A1246ILE A1055 | 1.41A | 20.00 | None |