5T8F

p110delta/p85alpha with taselisib (GDC-0032)

5T8F の概要

• エントリーDOI: 10.2210/pdb5t8f/pdb
• 分子名称: Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform, Phosphatidylinositol 3-kinase regulatory subunit alpha, 2-methyl-2-(4-{2-[3-methyl-1-(propan-2-yl)-1H-1,2,4-triazol-5-yl]-5,6-dihydroimidazo[1,2-d][1,4]benzoxazepin-9-yl}-1H-pyrazol-1-yl)propanamide, ... (4 entities in total)
• 機能のキーワード: pi3kdelta kinase, proteros biostructures gmbh, inhibitor, lipid kinase, transferase-transferase inhibitor complex, transferase/transferase inhibitor
• 由来する生物種: Homo sapiens (Human); 詳細
• 細胞内の位置: Cytoplasm : O00329
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 137527.25

構造登録者

Moertl, M.,Steinbacher, S.,Eigenbrot, C. (登録日: 2016-09-07, 公開日: 2017-01-11, 最終更新日: 2023-10-04)

• 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 (2.91 Å)