DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Beta-secretase 1
Ligand Name
N-((1S,2R)-3-(((1S)-2-(CYCLOHEXYLAMINO)-1-METHYL-2-OXOETHYL)AMINO)-2-HYDROXY-1-( PHENYLMETHYL)PROPYL)-3-((METHYLSULFONYL)(PHENYL)AMINO) BENZAMIDE
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
PSSKPAZTPVDDNS-RJSONGRPSA-N
SMILES
CC(C(=O)NC1CCCCC1)NCC(C(Cc2ccccc2)NC(=O)c3cccc(c3)N(c4ccccc4)S(=O)(=O)C)O
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 2XFI
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Color Legend
Unassigned regionsLigand / hetero atomse2xfiA2e2xfiA3
ECOD domains from experimental PDB structures interacting with ligand XFI
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P56817n/aXFI2xfie2xfiA2A:245-447
P56817n/aXFI2xfie2xfiA3A:62-244