Attributes
UniProt ID
Protein Name
Envelope glycoprotein
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: 8FAD
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Color Legend
Unassigned regionsLigand / hetero atomse8fadA1e8fadA2e8fadA3e8fadB1e8fadC1e8fadC2e8fadC3e8fadD1e8fadE1e8fadE2e8fadE3e8fadF1
ECOD domains from experimental PDB structures interacting with ligand 83G
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| B0FDK7 | n/a | 83G | 8fad | e8fadA1 | A:256-473 |
| B0FDK7 | n/a | 83G | 8fad | e8fadA2 | A:33-119,A:203-255,A:474-503 |
| B0FDK7 | n/a | 83G | 8fad | e8fadC1 | C:33-119,C:203-255,C:474-503 |
| B0FDK7 | n/a | 83G | 8fad | e8fadC2 | C:256-473 |
| B0FDK7 | n/a | 83G | 8fad | e8fadE1 | E:256-473 |
| B0FDK7 | n/a | 83G | 8fad | e8fadE2 | E:33-119,E:203-255,E:474-503 |