DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Beta-secretase 1
Ligand Name
(4S,4a'S,10a'R)-2-amino-8'-(2-fluoropyridin-3-yl)-1-methyl-3',4',4a',10a'-tetrahydro-2'H-spiro[imidazole-4,10'-pyrano[3,2-b]chromen]-5(1H)-one
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
GZRDWAATBYKNGI-FTRWYGJKSA-N
SMILES
CN1C(=O)C2(c3cc(ccc3OC4C2OCCC4)c5cccnc5F)N=C1N
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 4RRN
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Color Legend
Unassigned regionsLigand / hetero atomse4rrnA1e4rrnA2
ECOD domains from experimental PDB structures interacting with ligand 3UW
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P56817n/a3UW4rrne4rrnA1A:60-244
P56817n/a3UW4rrne4rrnA2A:245-459