4I4E

Structure of Focal Adhesion Kinase catalytic domain in complex with hinge binding pyrazolobenzothiazine compound.

4I4E の概要

• エントリーDOI: 10.2210/pdb4i4e/pdb
• 関連するPDBエントリー: 4EBV 4EBW 4I4F
• 分子名称: Focal adhesion kinase 1, [4-(2-hydroxyethyl)piperidin-1-yl][4-(5-methyl-4,4-dioxido-1,5-dihydropyrazolo[4,3-c][2,1]benzothiazin-8-yl)phenyl]methanone (3 entities in total)
• 機能のキーワード: phosphorylated on tyrosines, transferase, cytoplasmic; localized to focal adhesions, transferase-transferase inhibitor complex, transferase/transferase inhibitor
• 由来する生物種: Homo sapiens (human)
• 細胞内の位置: Cell junction, focal adhesion: Q05397
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 32586.69

構造登録者

Skene, R.J.,Hosfield, D.J. (登録日: 2012-11-27, 公開日: 2013-03-06, 最終更新日: 2023-09-20)

• 主引用文献: Tomita, N.,Hayashi, Y.,Suzuki, S.,Oomori, Y.,Aramaki, Y.,Matsushita, Y.,Iwatani, M.,Iwata, H.,Okabe, A.,Awazu, Y.,Isono, O.,Skene, R.J.,Hosfield, D.J.,Miki, H.,Kawamoto, T.,Hori, A.,Baba, A.; Structure-based discovery of cellular-active allosteric inhibitors of FAK.; Bioorg.Med.Chem.Lett., 23:1779-1785, 2013; PubMed: 23414845; DOI: 10.1016/j.bmcl.2013.01.047

実験手法

X-RAY DIFFRACTION (1.55 Å)