3ROC

Crystal structure of human p38 alpha complexed with a pyrimidinone compound

3ROC の概要

• エントリーDOI: 10.2210/pdb3roc/pdb
• 分子名称: Mitogen-activated protein kinase 14, 3-{5-chloro-4-[(2,4-difluorobenzyl)oxy]-6-oxopyrimidin-1(6H)-yl}-N-(2-hydroxyethyl)-4-methylbenzamide, 4-[4-(4-fluorophenyl)-1H-pyrazol-3-yl]pyridine, ... (4 entities in total)
• 機能のキーワード: transferase, transferase-transferase inhibitor complex, transferase/transferase inhibitor
• 由来する生物種: Homo sapiens (human)
• 細胞内の位置: Cytoplasm (By similarity): Q16539
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 42032.28

構造登録者

Shieh, H.-S.,Xing, L. (登録日: 2011-04-25, 公開日: 2011-06-15, 最終更新日: 2024-02-28)

• 主引用文献: Devadas, B.,Selness, S.R.,Xing, L.,Madsen, H.M.,Marrufo, L.D.,Shieh, H.,Messing, D.M.,Yang, J.Z.,Morgan, H.M.,Anderson, G.D.,Webb, E.G.,Zhang, J.,Devraj, R.V.,Monahan, J.B.; Substituted N-aryl-6-pyrimidinones: A new class of potent, selective, and orally active p38 MAP kinase inhibitors.; Bioorg.Med.Chem.Lett., 21:3856-3860, 2011; PubMed: 21620699; DOI: 10.1016/j.bmcl.2011.05.006

実験手法

X-RAY DIFFRACTION (1.7 Å)