DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Beta-secretase 1
Ligand Name
N-[(4S,8E,11S)-4-[(1R)-1-hydroxy-2-{[3-(propan-2-yl)benzyl]amino}ethyl]-2,13-dioxo-11-phenyl-6-oxa-3,12-diazabicyclo[12.3.1]octadeca-1(18),8,14,16-tetraen-16-yl]-N-methylmethanesulfonamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
XYJDOUBLYLOJJL-YNYOQIOBSA-N
SMILES
CC(C)c1cccc(c1)CNCC(C2COCC=CCC(NC(=O)c3cc(cc(c3)N(C)S(=O)(=O)C)C(=O)N2)c4ccccc4)O
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 4DPF
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Color Legend
Unassigned regionsLigand / hetero atomse4dpfA2e4dpfA3
ECOD domains from experimental PDB structures interacting with ligand 0LG
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P56817n/a0LG4dpfe4dpfA2A:232-433
P56817n/a0LG4dpfe4dpfA3A:47-231