DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
p450 monooxygenase
Ligand Name
S-[2-({N-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alanyl}amino)ethyl] 1H-imidazole-4-carbothioate
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
MLKHCPZWKVOVCY-LBPRGKRZSA-N
SMILES
CC(C)(COP(=O)(O)O)C(C(=O)NCCC(=O)NCCSC(=O)c1c[nH]cn1)O
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 4PWV
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Color Legend
Unassigned regionsLigand / hetero atomse4pwvA1e4pwvB1
ECOD domains from experimental PDB structures interacting with ligand KH4
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
F2YRY7n/aKH44pwve4pwvA1A:7-417
F2YRY7n/aKH44pxhe4pxhA1A:7-423
F2YRY7n/aKH44pxhe4pxhC1C:11-419
F2YRY7n/aKH44pxhe4pxhE1E:11-417