3OY3

Crystal structure of ABL T315I mutant kinase domain bound with a DFG-out inhibitor AP24589

3OY3 の概要

• エントリーDOI: 10.2210/pdb3oy3/pdb
• 関連するPDBエントリー: 3IK3 3OXZ
• 分子名称: Tyrosine-protein kinase ABL1, 5-[(5-{[4-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-3-(trifluoromethyl)phenyl]carbamoyl}-2-methylphenyl)ethynyl]-1-methyl-1H-imidazole-2-carboxamide (3 entities in total)
• 機能のキーワード: protein-inhibitor complex, protein kinase two-domain fold, phosphotransferase, atp binding, phosphorylation, transferase-transferase inhibitor complex, transferase/transferase inhibitor
• 由来する生物種: Mus musculus (mouse)
• 細胞内の位置: Cytoplasm, cytoskeleton: P00520
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 66756.16

構造登録者

Zhou, T.,Commodore, L.,Huang, W.S.,Wang, Y.,Thomas, M.,Keats, J.,Xu, Q.,Rivera, V.,Shakespeare, W.C.,Clackson, T.,Dalgarno, D.C.,Zhu, X. (登録日: 2010-09-22, 公開日: 2010-12-15, 最終更新日: 2023-09-06)

• 主引用文献: Zhou, T.,Commodore, L.,Huang, W.S.,Wang, Y.,Thomas, M.,Keats, J.,Xu, Q.,Rivera, V.M.,Shakespeare, W.C.,Clackson, T.,Dalgarno, D.C.,Zhu, X.; Structural Mechanism of the Pan-BCR-ABL Inhibitor Ponatinib (AP24534): Lessons for Overcoming Kinase Inhibitor Resistance.; Chem.Biol.Drug Des., 77:1-11, 2011; PubMed: 21118377; DOI: 10.1111/j.1747-0285.2010.01054.x

実験手法

X-RAY DIFFRACTION (1.95 Å)