5IE1

Crystal structure of BACE1 in complex with 3-(2-amino-6-(o-tolyl)quinolin-3-yl)-N-(3,3-dimethylbutyl)propanamide

5IE1 の概要

• エントリーDOI: 10.2210/pdb5ie1/pdb
• 分子名称: Beta-secretase 1, IODIDE ION, GLYCEROL, ... (5 entities in total)
• 機能のキーワード: aspartic protease, alzheimer's disease, app, amyloid precursor protein, hydrolase
• 由来する生物種: Homo sapiens (Human)
• 細胞内の位置: Membrane; Single-pass type I membrane protein: P56817
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 46903.78

構造登録者

Jordan, J.B.,Whittington, D.A.,Bartberger, M.D.,Sickmier, E.A.,Chen, K.,Cheng, Y.,Judd, T. (登録日: 2016-02-24, 公開日: 2016-03-30, 最終更新日: 2024-04-03)

• 主引用文献: Jordan, J.B.,Whittington, D.A.,Bartberger, M.D.,Sickmier, E.A.,Chen, K.,Cheng, Y.,Judd, T.; Fragment-Linking Approach Using (19)F NMR Spectroscopy To Obtain Highly Potent and Selective Inhibitors of beta-Secretase.; J.Med.Chem., 59:3732-3749, 2016; PubMed: 26978477; DOI: 10.1021/acs.jmedchem.5b01917

実験手法

X-RAY DIFFRACTION (2.298 Å)