DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Gag-Pol polyprotein
Ligand Name
(5S)-6,6-dimethyl-5-[(6R)-8-oxo-6,8-dihydrofuro[3,4-e][1,3]benzodioxol-6-yl]-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-6-ium
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
WDIQXKYUSINZME-RBUKOAKNSA-N
SMILES
C[N+]1(CCc2cc3c(cc2C1C4c5ccc6c(c5C(=O)O4)OCO6)OCO3)C
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 4IG3
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Color Legend
Unassigned regionsLigand / hetero atomse4ig3A5e4ig3A6e4ig3A7e4ig3A8e4ig3B2e4ig3B5e4ig3B6
ECOD domains from experimental PDB structures interacting with ligand J94
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P03366n/aJ944ig3e4ig3A8A:-1-239
P03366n/aJ944ig3e4ig3B6B:5-230