DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Gag-Pol polyprotein
Ligand Name
4-(3-chloro-5-cyanophenoxy)-3-[2-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)ethoxy]phenyl sulfurofluoridate
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
RUICQBSNQUGNNJ-UHFFFAOYSA-N
SMILES
c1cc(c(cc1OS(=O)(=O)F)OCCN2C=CC(=O)NC2=O)Oc3cc(cc(c3)Cl)C#N
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 7KRD
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Color Legend
Unassigned regionsLigand / hetero atomse7krdA1e7krdA2e7krdA3e7krdA4e7krdB1e7krdB2e7krdB3
ECOD domains from experimental PDB structures interacting with ligand X2S
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P03366n/aX2S7krde7krdA3A:2-239
P03366n/aX2S7krde7krdA4A:317-428
P03366n/aX2S7krde7krdB3B:5-230