3LAU

Crystal Structure of Aurora2 kinase in complex with a GSK3beta inhibitor

3LAU の概要

• エントリーDOI: 10.2210/pdb3lau/pdb
• 分子名称: Serine/threonine-protein kinase 6, N-[6-(4-hydroxyphenyl)-1H-indazol-3-yl]butanamide (3 entities in total)
• 機能のキーワード: kinase inhibitor complex, atp-binding, cell cycle, cytoplasm, cytoskeleton, kinase, nucleotide-binding, phosphoprotein, polymorphism, serine/threonine-protein kinase, transferase, ubl conjugation
• 由来する生物種: Homo sapiens (human)
• 細胞内の位置: Cytoplasm, cytoskeleton, microtubule organizing center, centrosome : O14965
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 33637.51

構造登録者

Maignan, S.,Guilloteau, J.P.,Pouzieux, S. (登録日: 2010-01-07, 公開日: 2010-03-02, 最終更新日: 2023-09-06)

主引用文献

Lesuisse, D.,Dutruc-Rosset, G.,Tiraboschi, G.,Dreyer, M.K.,Maignan, S.,Chevalier, A.,Halley, F.,Bertrand, P.,Burgevin, M.C.,Quarteronet, D.,Rooney, T.
Rational design of potent GSK3beta inhibitors with selectivity for Cdk1 and Cdk2.
Bioorg.Med.Chem.Lett., 20:1985-1989, 2010

PubMed Abstract: From an HTS hit, a series of potent and selective inhibitors of GSK3beta have been designed based on a Cdk2-homology model and with the help of several crystal structures of the compounds within Cdk2.

PubMed: 20167481
DOI: 10.1016/j.bmcl.2010.01.114

実験手法

X-RAY DIFFRACTION (2.1 Å)