Structure of Bace-1 (Beta-Secretase) in Complex with (2R)-N-((2S,3R)-1-(benzo[d][1,3]dioxol-5-yl)-3-hydroxy-4-((S)-6'-neopentyl-3',4'-dihydrospiro[cyclobutane-1,2'-pyrano[2,3-b]pyridine]-4'-ylamino)butan-2-yl)-2-methoxypropanamide

Structure of Bace-1 (Beta-Secretase) in Complex with (2R)-N-((2S,3R)-1-(benzo[d][1,3]dioxol-5-yl)-3-hydroxy-4-((S)-6'-neopentyl-3',4'-dihydrospiro[cyclobutane-1,2'-pyrano[2,3-b]pyridine]-4'-ylamino)butan-2-yl)-2-methoxypropanamide Descriptor: (2R)-N-[(2S,3R)-1-(1,3-benzodioxol-5-yl)-4-{[(4'S)-6'-(2,2-dimethylpropyl)-3',4'-dihydrospiro[cyclobutane-1,2'-pyrano[2,3-b]pyridin]-4'-yl]amino}-3-hydroxybutan-2-yl]-2-methoxypropanamide, Beta-secretase 1, GLYCEROL, ... Authors: Sickmier, E.A. Deposit date: 2012-01-27 Release date: 2012-04-18 Last modified: 2024-11-06 Method: X-RAY DIFFRACTION (2.5 Å) Cite: Design and preparation of a potent series of hydroxyethylamine containing beta-secretase inhibitors that demonstrate robust reduction of central beta-amyloid. J.Med.Chem., 55, 2012

BACE-1（β分泌酶1，Beta-Secretase）与(2R)-N-((2S,3R)-1-(苯并[d][1,3]二氧杂环戊烯-5-基)-3-羟基-4-((S)-6'-新戊基-3',4'-二氢螺[环丁烷-1,2'-吡喃并[2,3-b]吡啶]-4'-基氨基)丁-2-基)-2-甲氧基丙酰胺的复合物晶体结构
Descriptor: (2R)-N-[(2S,3R)-1-(1,3-苯并二氧杂环戊烯-5-基)-4-{[(4'S)-6'-(2,2-二甲基丙基)-3',4'-二氢螺[环丁烷-1,2'-吡喃并[2,3-b]吡啶]-4'-基]氨基}-3-羟基丁-2-基]-2-甲氧基丙酰胺、β分泌酶1、甘油（GLYCEROL）等
Authors: Sickmier, E.A.
Deposit date: 2012年1月27日
Release date: 2012年4月18日
Last modified: 2024年11月6日
Method: X射线衍射（X-RAY DIFFRACTION），分辨率2.5埃
Cite: 《含羟乙基胺的强效β分泌酶抑制剂系列的设计与制备：可显著降低中枢β淀粉样蛋白水平》，《药物化学杂志》（J.Med.Chem.，Journal of Medicinal Chemistry），55卷，2012年