5HNE

X-RAY CRYSTAL STRUCTURE OF HUMAN MITOCHONDRIAL BRANCHED CHAIN AMINOTRANSFERASE (BCATM) COMPLEXED WITH A 2-ARYL BENZIMIDAZOLE COMPOUND AND AN INTERNAL ALDIMINE LINKED PLP COFACTOR

5HNE の概要

• エントリーDOI: 10.2210/pdb5hne/pdb
• 関連するPDBエントリー: 5CR5
• 分子名称: Branched-chain-amino-acid aminotransferase, mitochondrial, PYRIDOXAL-5'-PHOSPHATE, 1-[(1R,3S)-3-{[(5-bromothiophen-2-yl)carbonyl]amino}cyclohexyl]-N-methyl-2-(pyridin-2-yl)-1H-benzimidazole-5-carboxamide, ... (7 entities in total)
• 機能のキーワード: fold type iv, transferase
• 由来する生物種: Homo sapiens (Human)
• 細胞内の位置: Isoform A: Mitochondrion. Isoform B: Cytoplasm: O15382
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 85743.60

構造登録者

Somers, D.O. (登録日: 2016-01-18, 公開日: 2016-05-04, 最終更新日: 2024-05-01)

• 主引用文献: Deng, H.,Zhou, J.,Sundersingh, F.,Messer, J.A.,Somers, D.O.,Ajakane, M.,Arico-Muendel, C.C.,Beljean, A.,Belyanskaya, S.L.,Bingham, R.,Blazensky, E.,Boullay, A.B.,Boursier, E.,Chai, J.,Carter, P.,Chung, C.W.,Daugan, A.,Ding, Y.,Herry, K.,Hobbs, C.,Humphries, E.,Kollmann, C.,Nguyen, V.L.,Nicodeme, E.,Smith, S.E.,Dodic, N.,Ancellin, N.; Discovery and Optimization of Potent, Selective, and in Vivo Efficacious 2-Aryl Benzimidazole BCATm Inhibitors.; Acs Med.Chem.Lett., 7:379-384, 2016; PubMed: 27096045; DOI: 10.1021/acsmedchemlett.5b00389

実験手法

X-RAY DIFFRACTION (2.04 Å)