5ZZ4

Crystal structure of bruton's tyrosine kinase in complex with inhibitor 2e

5ZZ4 の概要

• エントリーDOI: 10.2210/pdb5zz4/pdb
• 分子名称: Tyrosine-protein kinase BTK, N-[3-(4-amino-6-{[4-(morpholine-4-carbonyl)phenyl]amino}-1,3,5-triazin-2-yl)-2-methylphenyl]-4-tert-butylbenzamide (2 entities in total)
• 機能のキーワード: protein kinase, inhibitor complex, non-covalent, transferase-transferase inhibitor complex, transferase/transferase inhibitor
• 由来する生物種: Homo sapiens (Human)
• タンパク質・核酸の鎖数: 6
• 化学式量合計: 190467.55

構造登録者

Kawahata, W.,Asami, T.,Irie, T.,Kiyoi, T.,Taniguchi, H.,Asamitsu, Y.,Inoue, T.,Miyake, T.,Sawa, M. (登録日: 2018-05-30, 公開日: 2018-09-26, 最終更新日: 2023-11-22)

• 主引用文献: Kawahata, W.,Asami, T.,Kiyoi, T.,Irie, T.,Taniguchi, H.,Asamitsu, Y.,Inoue, T.,Miyake, T.,Sawa, M.; Design and Synthesis of Novel Amino-triazine Analogues as Selective Bruton's Tyrosine Kinase Inhibitors for Treatment of Rheumatoid Arthritis.; J. Med. Chem., 61:8917-8933, 2018; PubMed: 30216722; DOI: 10.1021/acs.jmedchem.8b01147

実験手法

X-RAY DIFFRACTION (2.9 Å)