DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Beta-secretase 1
Ligand Name
N-{(1S,2S)-2-[(4aS,7aR)-2-amino-4a,5-dihydro-4H-furo[3,4-d][1,3]thiazin-7a(7H)-yl]cyclopropyl}-5-fluoropyridine-2-carboxamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
OWWIYTVWTQBRDL-FGAILIKWSA-N
SMILES
c1cc(ncc1F)C(=O)NC2CC2C34COCC3CSC(=N4)N
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

Interactive Mol* view for the current protein-molecule pair.

Structure: 6UVP
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Color Legend
Unassigned regionsLigand / hetero atomse6uvpA1e6uvpA2e6uvpB1e6uvpB2
ECOD domains from experimental PDB structures interacting with ligand QJJ
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P56817n/aQJJ6uvpe6uvpA1A:-5-183
P56817n/aQJJ6uvpe6uvpA2A:184-385
P56817n/aQJJ6uvpe6uvpB2B:-1-183