2XNP

Structure of Nek2 bound to CCT244858

2XNP の概要

• エントリーDOI: 10.2210/pdb2xnp/pdb
• 関連するPDBエントリー: 2JAV 2W5A 2W5B 2W5H 2WQO 2XK3 2XK4 2XK6 2XK7 2XK8 2XKC 2XKD 2XKE 2XKF 2XNM 2XNN 2XNO
• 分子名称: SERINE/THREONINE-PROTEIN KINASE NEK2, 4-{5-[(1-METHYLPIPERIDIN-4-YL)OXY]-1H-BENZIMIDAZOL-1-YL}-2-{(1R)-1-[2-(TRIFLUOROMETHYL)PHENYL]ETHOXY}BENZAMIDE, CHLORIDE ION, ... (5 entities in total)
• 機能のキーワード: transferase, centrosome, mitosis, cell cycle
• 由来する生物種: HOMO SAPIENS (HUMAN)
• 細胞内の位置: Nucleus. Isoform 1: Nucleus, nucleolus. Isoform 2: Cytoplasm: P51955
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 33653.19

構造登録者

Mas-Droux, C.,Bayliss, R. (登録日: 2010-08-05, 公開日: 2011-03-30, 最終更新日: 2023-12-20)

• 主引用文献: Solanki, S.,Innocenti, P.,Mas-Droux, C.,Boxall, K.,Barillari, C.,Van Montfort, R.L.,Aherne, G.W.,Bayliss, R.,Hoelder, S.; Benzimidazole Inhibitors Induce a Dfg-Out Conformation of Never in Mitosis Gene A-Related Kinase 2 (Nek2) without Binding to the Back Pocket and Reveal a Nonlinear Structure-Activity Relationship.; J.Med.Chem., 54:1626-, 2011; PubMed: 21366329; DOI: 10.1021/JM1011726

実験手法

X-RAY DIFFRACTION (1.98 Å)