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TitleDesign of Potent and Highly Selective Inhibitors for Human beta-Secretase 2 (Memapsin 1), a Target for Type 2 Diabetes.
Journal, issue, pagesChem Sci, Vol. 7, Page 3117-3122, Year 2016
Publish dateSep 14, 2015 (structure data deposition date)
AuthorsGhosh, A.K. / Reddy, B.S. / Yen, Y.C. / Cardenas, E. / Rao, K.V. / Downs, D. / Huang, X. / Tang, J. / Mesecar, A.D.
External linksChem Sci / PubMed:27347366
MethodsX-ray diffraction
Resolution2.4651 Å
Structure data

PDB-5dqc:
Co-crystal of BACE1 with compound 0211
Method: X-RAY DIFFRACTION / Resolution: 2.4651 Å

Chemicals

ChemComp-5E7:
N-[(2S,3R)-3-hydroxy-4-({(2S,3S)-3-hydroxy-1-[(2-methylpropyl)amino]-1-oxobutan-2-yl}amino)-1-phenylbutan-2-yl]-5-[methyl(methylsulfonyl)amino]-N'-[(1R)-1-phenylethyl]benzene-1,3-dicarboxamide

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsHydrolase/Hydrolase Inhibitor / B-secretase / inhibitor / Alzheimer's disease / Hydrolase-Hydrolase Inhibitor complex

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