Attributes
UniProt ID
Protein Name
Beta-secretase 1
Ligand Name
(5S,8S,10R)-8-[(1R)-1-hydroxy-2-{[(5-propyl-1H-pyrazol-3-yl)methyl]amino}ethyl]-4,5,10-trimethyl-1-oxa-4,7-diazacyclohexadecane-3,6-dione
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
NLWPKRWRLRUIHJ-CQIJRDABSA-N
SMILES
CCCc1cc(n[nH]1)CNCC(C2CC(CCCCCCOCC(=O)N(C(C(=O)N2)C)C)C)O
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 5QD0
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Color Legend
Unassigned regionsLigand / hetero atomse5qd0A1e5qd0A2e5qd0B1e5qd0B2e5qd0C1e5qd0C2
ECOD domains from experimental PDB structures interacting with ligand E5Y