3PDJ

Crystal Structure of Human 11-beta-Hydroxysteroid Dehydrogenase 1 (11b-HSD1) in Complex with 4,4-Disubstituted Cyclohexylbenzamide Inhibitor

3PDJ の概要

• エントリーDOI: 10.2210/pdb3pdj/pdb
• 関連するPDBエントリー: 3BZU 3CZR 3D3E 3D4N 3D5Q 3FCO 3FRJ
• 分子名称: Corticosteroid 11-beta-dehydrogenase isozyme 1, N-[trans-4-(3-amino-3-oxopropyl)-4-phenylcyclohexyl]-N-cyclopropyl-4-[(1S)-2,2,2-trifluoro-1-hydroxy-1-methylethyl]benzamide, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ... (4 entities in total)
• 機能のキーワード: 11beta, hydroxysteroid, dehydrogenase, oxidoreductase-oxidoreductase inhibitor complex, oxidoreductase/oxidoreductase inhibitor
• 由来する生物種: Homo sapiens (human)
• 細胞内の位置: Endoplasmic reticulum membrane; Single-pass type II membrane protein: P28845
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 62705.91

構造登録者

Wang, Z.,Sudom, A.,Walker, N.P. (登録日: 2010-10-22, 公開日: 2011-10-05, 最終更新日: 2024-02-21)

• 主引用文献: Sun, D.,Wang, Z.,Caille, S.,DeGraffenreid, M.,Gonzalez-Lopez de Turiso, F.,Hungate, R.,Jaen, J.C.,Jiang, B.,Julian, L.D.,Kelly, R.,McMinn, D.L.,Kaizerman, J.,Rew, Y.,Sudom, A.,Tu, H.,Ursu, S.,Walker, N.,Willcockson, M.,Yan, X.,Ye, Q.,Powers, J.P.; Synthesis and Optimization of Novel 4,4-Disubstituted Cyclohexylbenzamide Derivatives as Potent 11beta-HSD1 Inhibitors; Bioorg.Med.Chem.Lett., 21:405-410, 2011; PubMed: 21093258; DOI: 10.1016/j.bmcl.2010.10.129

実験手法

X-RAY DIFFRACTION (2.3 Å)