8DEG

Crystal structure of DLK in complex with inhibitor DN0011197

8DEG の概要

• エントリーDOI: 10.2210/pdb8deg/pdb
• 分子名称: Mitogen-activated protein kinase kinase kinase 12, methyl (1S,4S)-5-{(4P)-4-[5-amino-6-(difluoromethoxy)pyrazin-2-yl]-6-[(1R,4R)-2-azabicyclo[2.1.1]hexan-2-yl]pyridin-2-yl}-2,5-diazabicyclo[2.2.1]heptane-2-carboxylate (3 entities in total)
• 機能のキーワード: dlk, kinase, inhibitor, signaling protein, transferase-inhibitor complex, transferase/inhibitor
• 由来する生物種: Homo sapiens (human)
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 36883.27

構造登録者

Srivastava, A.,Lexa, K.,de Vicente, J. (登録日: 2022-06-20, 公開日: 2022-12-14, 最終更新日: 2024-04-03)

• 主引用文献: Craig 2nd, R.A.,Fox, B.M.,Hu, C.,Lexa, K.W.,Osipov, M.,Thottumkara, A.P.,Larhammar, M.,Miyamoto, T.,Rana, A.,Kane, L.A.,Yulyaningsih, E.,Solanoy, H.,Nguyen, H.,Chau, R.,Earr, T.,Kajiwara, Y.,Fleck, D.,Lucas, A.,Haddick, P.C.G.,Takahashi, R.H.,Tong, V.,Wang, J.,Canet, M.J.,Poda, S.B.,Scearce-Levie, K.,Srivastava, A.,Sweeney, Z.K.,Xu, M.,Zhang, R.,He, J.,Lei, Y.,Zhuo, Z.,de Vicente, J.; Discovery of Potent and Selective Dual Leucine Zipper Kinase/Leucine Zipper-Bearing Kinase Inhibitors with Neuroprotective Properties in In Vitro and In Vivo Models of Amyotrophic Lateral Sclerosis.; J.Med.Chem., 65:16290-16312, 2022; PubMed: 36469401; DOI: 10.1021/acs.jmedchem.2c01056

実験手法

X-RAY DIFFRACTION (2.79 Å)