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
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Structure: 8FAE
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Color Legend
Unassigned regionsLigand / hetero atomse8faeA1e8faeA2e8faeA3e8faeB1e8faeC1e8faeC2e8faeC3e8faeD1e8faeE1e8faeE2e8faeE3e8faeF1
ECOD domains from experimental PDB structures interacting with ligand 83G
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| O40222 | n/a | 83G | 8fae | e8faeA2 | A:256-473 |
| O40222 | n/a | 83G | 8fae | e8faeA3 | A:32-119,A:203-255,A:474-505 |
| O40222 | n/a | 83G | 8fae | e8faeC2 | C:256-473 |
| O40222 | n/a | 83G | 8fae | e8faeC3 | C:33-119,C:203-255,C:474-505 |
| O40222 | n/a | 83G | 8fae | e8faeE1 | E:120-202 |
| O40222 | n/a | 83G | 8fae | e8faeE2 | E:256-473 |
| O40222 | n/a | 83G | 8fae | e8faeE3 | E:33-119,E:203-255,E:474-505 |