DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Gag-Pol polyprotein
Ligand Name
methyl [(2S)-1-(2-{(4R)-4-hydroxy-5-{[(2S)-3-methyl-1-oxo-1-(prop-2-en-1-ylamino)butan-2-yl]amino}-5-oxo-4-[4-(prop-2-en-1-yl)benzyl]pentyl}-2-[4-(pyridin-4-yl)benzyl]hydrazinyl)-3,3-dimethyl-1-oxobutan-2-yl]carbamate
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
AZJLJLJSOQLYEA-COCJHVOVSA-N
SMILES
CC(C)C(C(=O)NCC=C)NC(=O)C(CCCN(Cc1ccc(cc1)c2ccncc2)NC(=O)C(C(C)(C)C)NC(=O)OC)(Cc3ccc(cc3)CC=C)O
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 4CP7
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Color Legend
Unassigned regionsLigand / hetero atomse4cp7A1e4cp7B1
ECOD domains from experimental PDB structures interacting with ligand 9MW
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P03366n/a9MW4cp7e4cp7A1A:1-99
P03366n/a9MW4cp7e4cp7B1B:101-199
P03366n/a9MW4cpqe4cpqA1A:1-99
P03366n/a9MW4cpqe4cpqB1B:101-199