DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Beta-secretase 1
Ligand Name
~{N}-[6-[(3~{R},6~{R})-5-azanyl-3,6-dimethyl-6-(trifluoromethyl)-2~{H}-1,4-oxazin-3-yl]-5-fluoranyl-pyridin-2-yl]-3-chloranyl-5-(trifluoromethyl)pyridine-2-carboxamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
PSBBWFNMHDUTRH-DLBZAZTESA-N
SMILES
CC1(COC(C(=N1)N)(C)C(F)(F)F)c2c(ccc(n2)NC(=O)c3c(cc(cn3)C(F)(F)F)Cl)F
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 6EQM
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Color Legend
Unassigned regionsLigand / hetero atomse6eqmA1e6eqmA2
ECOD domains from experimental PDB structures interacting with ligand BUH
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P56817n/aBUH6eqme6eqmA1A:-2-183
P56817n/aBUH6eqme6eqmA2A:184-385