8V1O

Crystal structure of IRAK4 kinase domain with compound 4

8V1O の概要

• エントリーDOI: 10.2210/pdb8v1o/pdb
• 分子名称: Interleukin-1 receptor-associated kinase 4, N-[2-(3-hydroxy-3-methylbutyl)-6-(2-hydroxypropan-2-yl)-2H-indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide, GLYCEROL, ... (6 entities in total)
• 機能のキーワード: kinase for important for immune response. protac design., immune system
• 由来する生物種: Homo sapiens (human)
• タンパク質・核酸の鎖数: 4
• 化学式量合計: 150924.24

構造登録者

Weiss, M.M.,Zheng, X.,Browne, C.M.,Campbell, V.,Chen, D.,Enerson, B.,Fei, X.,Huang, X.,Klaus, C.R.,Li, H.,Mayo, M.,McDonald, A.A.,Paul, A.,Sharma, K.,Shi, Y.,Slavin, A.,Walter, D.M.,Yuan, K.,Zhang, Y.,Zhu, X.,Kelleher, J.,Ji, N.,Walker, D.,Mainolfi, N. (登録日: 2023-11-21, 公開日: 2024-07-03, 最終更新日: 2024-07-24)

• 主引用文献: Weiss, M.M.,Zheng, X.,Ji, N.,Browne, C.M.,Campbell, V.,Chen, D.,Enerson, B.,Fei, X.,Huang, X.,Klaus, C.R.,Li, H.,Mayo, M.,McDonald, A.A.,Paul, A.,Rong, H.,Sharma, K.,Shi, Y.,Slavin, A.,Walther, D.M.,Yuan, K.,Zhang, Y.,Zhu, X.,Kelleher, J.,Walker, D.,Mainolfi, N.; Discovery of KT-413, a Targeted Protein Degrader of IRAK4 and IMiD Substrates Targeting MYD88 Mutant Diffuse Large B-Cell Lymphoma.; J.Med.Chem., 67:10548-10566, 2024; PubMed: 38920289; DOI: 10.1021/acs.jmedchem.3c01823

実験手法

X-RAY DIFFRACTION (2.92 Å)