4GEB

Kynurenine Aminotransferase II Inhibitors

4GEB の概要

• エントリーDOI: 10.2210/pdb4geb/pdb
• 関連するPDBエントリー: 4GDY 4GE4 4GE7 4GE9
• 分子名称: Kynurenine/alpha-aminoadipate aminotransferase, mitochondrial, (5-hydroxy-4-{[(7-hydroxy-6-oxo-2-phenyl-6,7-dihydro-2H-pyrazolo[3,4-b]pyridin-5-yl)amino]methyl}-6-methylpyridin-3-yl)methyl dihydrogen phosphate, SULFATE ION, ... (4 entities in total)
• 機能のキーワード: aminotransferase, irreversible inhibitor, transferase-transferase inhibitor complex, transferase/transferase inhibitor
• 由来する生物種: Homo sapiens (human)
• 細胞内の位置: Mitochondrion (Potential): Q8N5Z0
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 99231.15

構造登録者

Pandit, J. (登録日: 2012-08-01, 公開日: 2013-03-20, 最終更新日: 2023-09-13)

• 主引用文献: Dounay, A.B.,Anderson, M.,Bechle, B.M.,Evrard, E.,Gan, X.,Kim, J.Y.,McAllister, L.A.,Pandit, J.,Rong, S.,Salafia, M.A.,Tuttle, J.B.,Zawadzke, L.E.,Verhoest, P.R.; PF-04859989 as a template for structure-based drug design: identification of new pyrazole series of irreversible KAT II inhibitors with improved lipophilic efficiency.; Bioorg.Med.Chem.Lett., 23:1961-1966, 2013; PubMed: 23466229; DOI: 10.1016/j.bmcl.2013.02.039

実験手法

X-RAY DIFFRACTION (2.15 Å)