4I0I

SPR and structural analysis yield insight towards mechanism of inhibition of BACE inhibitors

Summary for 4I0I

• Entry DOI: 10.2210/pdb4i0i/pdb
• Related: 4I0H 4I0J
• Descriptor: Beta-secretase 1, N-[(1S,2R)-1-(3,5-difluorobenzyl)-3-({1-[4-(2,2-dimethylpropyl)thiophen-2-yl]cyclopropyl}amino)-2-hydroxypropyl]acetamide (3 entities in total)
• Functional Keywords: bace, aspartic protease, hydrolysis, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
• Biological source: Homo sapiens (human)
• Cellular location: Membrane; Single-pass type I membrane protein: P56817
• Total number of polymer chains: 3
• Total formula weight: 137687.12

Authors

Yao, N.,Brecht, E. (deposition date: 2012-11-16, release date: 2013-11-20, Last modification date: 2024-11-06)

• Primary citation: Mondal, K.,Regnstrom, K.,Morishige, W.,Barbour, R.,Beroza, P.,Yao, N.,Bova, M.P.; SPR and structural analysis yield insight towards mechanism of inhibition of BACE inhibitors; To be Published,

Experimental method

X-RAY DIFFRACTION (2.2 Å)