DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Beta-secretase 1
Ligand Name
[(1~{R},2~{R})-2-[(4~{S})-2-azanyl-4-[4-[bis(fluoranyl)methoxy]phenyl]-5~{H}-1,3-oxazol-4-yl]cyclopropyl]-(5-chloranylpyridin-3-yl)methanone
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
AVRZQFKBYKMVDH-SPYBWZPUSA-N
SMILES
c1cc(ccc1C2(COC(=N2)N)C3CC3C(=O)c4cc(cnc4)Cl)OC(F)F
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 5EZX
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Color Legend
Unassigned regionsLigand / hetero atomse5ezxA1e5ezxA2
ECOD domains from experimental PDB structures interacting with ligand 5T5
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P56817n/a5T55ezxe5ezxA1A:57-244
P56817n/a5T55ezxe5ezxA2A:245-446
P56817n/a5T56dmie6dmiA1A:245-446
P56817n/a5T56dmie6dmiA2A:57-244