DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Cytochrome P450 3A4
Ligand Name
N~2~-(methyl{[2-(propan-2-yl)-1,3-thiazol-4-yl]methyl}carbamoyl)-N-[(2R,5S)-1-phenyl-5-{[(1,3-thiazol-5-ylmethoxy)carbonyl]amino}octan-2-yl]-L-valinamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
SMWGYCRIYRMWHW-HFASVGIHSA-N
SMILES
CCCC(CCC(Cc1ccccc1)NC(=O)C(C(C)C)NC(=O)N(C)Cc2csc(n2)C(C)C)NC(=O)OCc3cncs3
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 4K9W
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Color Legend
Unassigned regionsLigand / hetero atomse4k9wA1e4k9wB1e4k9wC1e4k9wD1
ECOD domains from experimental PDB structures interacting with ligand 7AW
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P08684n/a7AW4k9we4k9wA1A:29-496
P08684n/a7AW4k9we4k9wB1B:29-496
P08684n/a7AW4k9we4k9wC1C:29-496
P08684n/a7AW4k9we4k9wD1D:29-496