5T8P

Crystal structure of murine NF-kappaB inducing kinase (NIK) bound to benzoxepin compound 2

5T8P の概要

• エントリーDOI: 10.2210/pdb5t8p/pdb
• 分子名称: Mitogen-activated protein kinase kinase kinase 14, 6,7-dihydrothieno[4,5]oxepino[1,2-~{c}]pyridine-2-carboxamide, SULFATE ION, ... (4 entities in total)
• 機能のキーワード: protein serine/threonine kinase, nf-kappab, map3k14, transferase
• 由来する生物種: Mus musculus (Mouse)
• 細胞内の位置: Cytoplasm: Q9WUL6
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 77963.72

構造登録者

Smith, M.A.,McEwan, P.A. (登録日: 2016-09-08, 公開日: 2017-01-11, 最終更新日: 2017-02-08)

• 主引用文献: Castanedo, G.M.,Blaquiere, N.,Beresini, M.,Bravo, B.,Brightbill, H.,Chen, J.,Cui, H.F.,Eigenbrot, C.,Everett, C.,Feng, J.,Godemann, R.,Gogol, E.,Hymowitz, S.,Johnson, A.,Kayagaki, N.,Kohli, P.B.,Knuppel, K.,Kraemer, J.,Kruger, S.,Loke, P.,McEwan, P.,Montalbetti, C.,Roberts, D.A.,Smith, M.,Steinbacher, S.,Sujatha-Bhaskar, S.,Takahashi, R.,Wang, X.,Wu, L.C.,Zhang, Y.,Staben, S.T.; Structure-Based Design of Tricyclic NF-kappa B Inducing Kinase (NIK) Inhibitors That Have High Selectivity over Phosphoinositide-3-kinase (PI3K).; J. Med. Chem., 60:627-640, 2017; PubMed: 28005357; DOI: 10.1021/acs.jmedchem.6b01363

実験手法

X-RAY DIFFRACTION (2.32 Å)