DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Gag-Pol polyprotein
Ligand Name
N-[[3-FLUORO-4-ETHOXY-PYRID-2-YL]ETHYL]-N'-[5-NITRILOMETHYL-PYRIDYL]-THIOUREA
DrugBank ID
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
PQSCCWFMTRVFDA-UHFFFAOYSA-N
SMILES
CCOc1ccnc(c1F)CCNC(=S)Nc2ccc(cn2)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: 1DTQ
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Color Legend
Unassigned regionsLigand / hetero atomse1dtqA10e1dtqA11e1dtqA12e1dtqA9e1dtqB1e1dtqB2e1dtqB3
ECOD domains from experimental PDB structures interacting with ligand DB07781
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P04585DB07781FPT1dtqe1dtqA11A:4-242
P04585DB07781FPT1dtqe1dtqA9A:317-428
P04585DB07781FPT1dtqe1dtqB2B:5-241