3P2V

Novel Benzothiazepine Inhibitor in Complex with human Aldose Reductase

3P2V の概要

• エントリーDOI: 10.2210/pdb3p2v/pdb
• 関連するPDBエントリー: 2PZN 3LEN 3M01 3MB9
• 分子名称: Aldose reductase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, [(2S)-4-oxo-2-phenyl-3,4-dihydro-1,5-benzothiazepin-5(2H)-yl]acetic acid, ... (4 entities in total)
• 機能のキーワード: tim barrel, oxidoreductase-oxidoreductase inhibitor complex, oxidoreductase/oxidoreductase inhibitor
• 由来する生物種: Homo sapiens (human)
• 細胞内の位置: Cytoplasm: P15121
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 37268.49

構造登録者

Koch, C.,Heine, A.,Klebe, G. (登録日: 2010-10-04, 公開日: 2011-08-24, 最終更新日: 2023-11-01)

主引用文献

Koch, C.,Heine, A.,Klebe, G.
Ligand-induced fit affects binding modes and provokes changes in crystal packing of aldose reductase
Biochim.Biophys.Acta, 1810:879-887, 2011

PubMed Abstract: Flexibility is a common feature of proteins. For human aldose reductase, a variety of conformers have been observed in crystalline complexes with different inhibitors.

PubMed: 21684320
DOI: 10.1016/j.bbagen.2011.06.001

実験手法

X-RAY DIFFRACTION (1.69 Å)