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2ZJK

Crystal structure of the human BACE1 catalytic domain in complex with 4-(4-fluoro-benzyl)-piperazine-2-carboxylic acid(3-mercapto-propyl)-amide

Summary for 2ZJK
Entry DOI10.2210/pdb2zjk/pdb
Related2ZJH 2ZJI 2ZJJ 2ZJL 2ZJM 2ZJN
DescriptorBeta-secretase 1, (2S)-4-(4-fluorobenzyl)-N-(3-sulfanylpropyl)piperazine-2-carboxamide (2 entities in total)
Functional Keywordsbace1, small-molecule inhibitor, tethering, alternative splicing, aspartyl protease, glycoprotein, hydrolase, membrane, protease, transmembrane, zymogen
Biological sourceHomo sapiens (Human)
Cellular locationMembrane; Single-pass type I membrane protein: P56817
Total number of polymer chains3
Total formula weight136657.04
Authors
Randal, M.,Lam, M.B.,Lu, W.,Romanowski, M.J. (deposition date: 2008-03-07, release date: 2009-01-20, Last modification date: 2023-11-01)
Primary citationYang, W.,Fucini, R.V.,Fahr, B.T.,Randal, M.,Lind, K.E.,Lam, M.B.,Lu, W.,Lu, Y.,Cary, D.R.,Romanowski, M.J.
Fragment-based discovery of novel BACE1 inhibitors using Tethering technology
To be Published,
Experimental method
X-RAY DIFFRACTION (3 Å)
Structure validation

217705

数据于2024-03-27公开中

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