5CTP

Crystal structure of CK2alpha with N-(3-(3-chloro-4-(phenyl)benzylamino)propyl)acetamide bound

5CTP の概要

• エントリーDOI: 10.2210/pdb5ctp/pdb
• 分子名称: Casein kinase II subunit alpha, ACETATE ION, N-(3-{[(2-chlorobiphenyl-4-yl)methyl]amino}propyl)acetamide, ... (5 entities in total)
• 機能のキーワード: ck2alpha, ck2a, fragment based drug discovery, high concentration screening, selective atp competitive inhibitors, surface entrophy reduction, transferase
• 由来する生物種: Homo sapiens (Human)
• 細胞内の位置: Nucleus : P68400
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 83900.38

構造登録者

Brear, P.,De Fusco, C.,Georgiou, K.H.,Spring, D.,Hyvonen, M. (登録日: 2015-07-24, 公開日: 2016-11-30, 最終更新日: 2024-01-10)

• 主引用文献: De Fusco, C.,Brear, P.,Iegre, J.,Georgiou, K.H.,Sore, H.F.,Hyvonen, M.,Spring, D.R.; A fragment-based approach leading to the discovery of a novel binding site and the selective CK2 inhibitor CAM4066.; Bioorg. Med. Chem., 25:3471-3482, 2017; PubMed: 28495381; DOI: 10.1016/j.bmc.2017.04.037

実験手法

X-RAY DIFFRACTION (2.033 Å)