2GMV

PEPCK complex with a GTP-competitive inhibitor

2GMV の概要

• エントリーDOI: 10.2210/pdb2gmv/pdb
• 関連するPDBエントリー: 1KHB 1M51 1NHX
• 分子名称: Phosphoenolpyruvate carboxykinase, cytosolic, MANGANESE (II) ION, PHOSPHOENOLPYRUVATE, ... (5 entities in total)
• 機能のキーワード: gluconeogenesis, xanthine, inhibitor, lyase
• 由来する生物種: Homo sapiens (human)
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 140070.98

構造登録者

Dunten, P. (登録日: 2006-04-07, 公開日: 2007-05-29, 最終更新日: 2024-02-14)

主引用文献

Pietranico, S.L.,Foley, L.H.,Huby, N.,Yun, W.,Dunten, P.,Vermeulen, J.,Wang, P.,Toth, K.,Ramsey, G.,Gubler, M.L.,Wertheimer, S.J.
C-8 Modifications of 3-alkyl-1,8-dibenzylxanthines as inhibitors of human cytosolic phosphoenolpyruvate carboxykinase.
Bioorg.Med.Chem.Lett., 17:3835-3839, 2007

PubMed Abstract: New modifications on the C-8 4-aminobenzyl unit of the previously reported 3-alkyl-1,8-dibenzylxanthine inhibitors of cPEPCK are presented. The most active compound reported here is the 5-chloro-1,3-dimethyl-1H-pyrazole-4-sulfonic acid amide derivative 2 with an IC(50) of 0.29+/-0.08 microM. An X-ray analysis of a heteroaromatic sulfonamide is presented showing a new pi-pi interaction.

PubMed: 17532214
DOI: 10.1016/j.bmcl.2007.05.013

実験手法

X-RAY DIFFRACTION (2.3 Å)