DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Gag-Pol polyprotein
Ligand Name
N-(3-{2-[5-chloro-2-(3-chloro-5-cyanophenoxy)phenoxy]ethyl}phenyl)prop-2-enamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
JKEJVDFTNRUUBQ-UHFFFAOYSA-N
SMILES
C=CC(=O)Nc1cccc(c1)CCOc2cc(ccc2Oc3cc(cc(c3)Cl)C#N)Cl
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

Interactive Mol* view for the current protein-molecule pair.

Structure: 8U6A
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Color Legend
Unassigned regionsLigand / hetero atomse8u6aA1e8u6aA2e8u6aA3e8u6aA4e8u6aB1e8u6aB2e8u6aB3
ECOD domains from experimental PDB structures interacting with ligand VQK
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P03366n/aVQK8u6ae8u6aA1A:317-428
P03366n/aVQK8u6ae8u6aA4A:-1-239