Attributes
UniProt ID
Protein Name
Envelope glycoprotein gp160
Ligand Name
1-[(2R)-4-(benzenecarbonyl)-2-methylpiperazin-1-yl]-2-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)ethane-1,2-dione
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
OKGPFTLYBPQBIX-CQSZACIVSA-N
SMILES
CC1CN(CCN1C(=O)C(=O)c2c[nH]c3c2c(ccn3)OC)C(=O)c4ccccc4
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 7N6U
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Color Legend
Unassigned regionsLigand / hetero atomse7n6uA1e7n6uA2e7n6uA3e7n6uA4e7n6uB1e7n6uB2e7n6uB3e7n6uB4e7n6uC1e7n6uC2e7n6uC3e7n6uC4
ECOD domains from experimental PDB structures interacting with ligand 83G
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| Q75760 | n/a | 83G | 7n6u | e7n6uA1 | A:256-482 |
| Q75760 | n/a | 83G | 7n6u | e7n6uA2 | A:32-119,A:203-257 |
| Q75760 | n/a | 83G | 7n6u | e7n6uB1 | B:256-482 |
| Q75760 | n/a | 83G | 7n6u | e7n6uB2 | B:31-119,B:203-257 |
| Q75760 | n/a | 83G | 7n6u | e7n6uB4 | B:120-202 |
| Q75760 | n/a | 83G | 7n6u | e7n6uC1 | C:256-482 |
| Q75760 | n/a | 83G | 7n6u | e7n6uC2 | C:31-119,C:203-257 |
| Q75760 | n/a | 83G | 7n6w | e7n6wA1 | A:256-482 |
| Q75760 | n/a | 83G | 7n6w | e7n6wA2 | A:32-119,A:203-257 |
| Q75760 | n/a | 83G | 7n6w | e7n6wB1 | B:256-482 |
| Q75760 | n/a | 83G | 7n6w | e7n6wB2 | B:31-119,B:203-257 |
| Q75760 | n/a | 83G | 7n6w | e7n6wB4 | B:120-202 |
| Q75760 | n/a | 83G | 7n6w | e7n6wC1 | C:256-484 |
| Q75760 | n/a | 83G | 7n6w | e7n6wC2 | C:31-119,C:203-257 |