DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Beta-secretase 1
Ligand Name
(4~{S},6~{S})-4-[2,4-bis(fluoranyl)phenyl]-6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-methyl-5,6-dihydro-1,3-thiazin-2-amine
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
XCTPNVXKKHOANI-BBRMVZONSA-N
SMILES
Cc1c(c(on1)C)C2CC(N=C(S2)N)(C)c3ccc(cc3F)F
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 5KR8
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Color Legend
Unassigned regionsLigand / hetero atomse5kr8A1e5kr8A2
ECOD domains from experimental PDB structures interacting with ligand 6WE
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P56817n/a6WE5kr8e5kr8A1A:47-231
P56817n/a6WE5kr8e5kr8A2A:232-433