4AL4

rat LDHA in complex with 2-((4-(2-((3-((2-methyl-1,3-benzothiazol-6- yl)amino)3-oxo-propyl)carbamoylamino)ethoxy)phenyl)methylpropanedioic acid

4AL4 の概要

• エントリーDOI: 10.2210/pdb4al4/pdb
• 関連するPDBエントリー: 4AJ1 4AJ2 4AJ4 4AJE 4AJH 4AJI 4AJJ 4AJK 4AJL 4AJN 4AJO
• 分子名称: L-LACTATE DEHYDROGENASE A CHAIN, GLYCEROL, 2-[[4-[2-[[3-[(2-methyl-1,3-benzothiazol-6-yl)amino]-3-oxidanylidene-propyl]carbamoylamino]ethoxy]phenyl]methyl]propanedioic acid, ... (4 entities in total)
• 機能のキーワード: oxidoreductase-inhibitor complex, fragment based lead generated inhibitors, oxidoreductase/inhibitor
• 由来する生物種: RATTUS NORVEGICUS (NORWAY RAT)
• 細胞内の位置: Cytoplasm: P04642
• タンパク質・核酸の鎖数: 4
• 化学式量合計: 149146.90

構造登録者

Tucker, J.A.,Brassington, C.,Hassall, G.,Ward, R.,Tart, J.,Davies, G.,Hohson, M.,Pearson, S. (登録日: 2012-03-01, 公開日: 2012-03-21, 最終更新日: 2024-05-01)

• 主引用文献: Ward, R.,Brassington, C.,Breeze, A.L.,Caputo, A.,Critchlow, S.,Davies, G.,Goodwin, L.,Hassall, G.,Greenwood, R.,Holdgate, G.,Mrosek, M.,Norman, R.A.,Pearson, S.,Tart, J.,Tucker, J.A.,Vogtherr, M.,Whittaker, D.,Wingfield, J.,Winter, J.,Hudson, K.; The Design and Synthesis of Novel Lactate Dehydrogenase a Inhibitors by Fragment-Based Lead Generation; J.Med.Chem., 55:3285-, 2012; PubMed: 22417091; DOI: 10.1021/JM201734R

実験手法

X-RAY DIFFRACTION (1.78 Å)