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)
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)

Structure validation