5V5N

Crystal structure of Takinib bound to TAK1

5V5N の概要

• エントリーDOI: 10.2210/pdb5v5n/pdb
• 分子名称: Mitogen-activated protein kinase kinase kinase 7/TGF-beta-activated kinase 1 and MAP3K7-binding protein 1 chimera, N~1~-(1-propyl-1,3-dihydro-2H-benzimidazol-2-ylidene)benzene-1,3-dicarboxamide (3 entities in total)
• 機能のキーワード: tak1, inhibitor, hydrogen bond, dfg-in, transferase-transferase inhibitor complex, transferase/transferase inhibitor
• 由来する生物種: Homo sapiens (Human); 詳細
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 35103.47

構造登録者

Gurbani, D.,Westover, K.,Bera, A.K. (登録日: 2017-03-14, 公開日: 2017-08-30, 最終更新日: 2023-10-04)

• 主引用文献: Totzke, J.,Gurbani, D.,Raphemot, R.,Hughes, P.F.,Bodoor, K.,Carlson, D.A.,Loiselle, D.R.,Bera, A.K.,Eibschutz, L.S.,Perkins, M.M.,Eubanks, A.L.,Campbell, P.L.,Fox, D.A.,Westover, K.D.,Haystead, T.A.J.,Derbyshire, E.R.; Takinib, a Selective TAK1 Inhibitor, Broadens the Therapeutic Efficacy of TNF-alpha Inhibition for Cancer and Autoimmune Disease.; Cell Chem Biol, 24:1029-1039.e7, 2017; PubMed: 28820959; DOI: 10.1016/j.chembiol.2017.07.011

実験手法

X-RAY DIFFRACTION (2.006 Å)