4TPT

Crystal Structure of the Human LIMK2 Kinase Domain In Complex With a Non-ATP Competitive Inhibitor

4TPT の概要

• エントリーDOI: 10.2210/pdb4tpt/pdb
• 分子名称: LIM domain kinase 2, N-{4-[(1S)-1,2-dihydroxyethyl]benzyl}-N-methyl-4-(phenylsulfamoyl)benzamide (3 entities in total)
• 機能のキーワード: limk2 kinase, dfg inhibitor, transferase-transferase inhibitor complex, transferase/transferase inhibitor
• 由来する生物種: Homo sapiens (Human)
• 細胞内の位置: Isoform LIMK2a: Cytoplasm. Isoform LIMK2b: Cytoplasm: P53671
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 70043.89

構造登録者

Goodwin, N.C.,Cianchetta, G.,Hamman, B.L.,Burgoon, H.A.,Healy, J.,Mabon, S.,Strobel, E.D.,Wang, S.,Rawlins, D.B. (登録日: 2014-06-09, 公開日: 2014-10-22, 最終更新日: 2023-12-27)

• 主引用文献: Goodwin, N.C.,Cianchetta, G.,Burgoon, H.A.,Healy, J.,Mabon, R.,Strobel, E.D.,Allen, J.,Wang, S.,Hamman, B.D.,Rawlins, D.B.; Discovery of a Type III Inhibitor of LIM Kinase 2 That Binds in a DFG-Out Conformation.; Acs Med.Chem.Lett., 6:53-57, 2015; PubMed: 25589930; DOI: 10.1021/ml500242y

実験手法

X-RAY DIFFRACTION (2.6 Å)