3G0C

Crystal structure of dipeptidyl peptidase IV in complex with a pyrimidinedione inhibitor 1

3G0C の概要

• エントリーDOI: 10.2210/pdb3g0c/pdb
• 関連するPDBエントリー: 3G0B 3G0D 3G0G
• 分子名称: Dipeptidyl peptidase 4, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, 7-(2-chlorobenzyl)-1,3-dimethyl-8-piperazin-1-yl-3,7-dihydro-1H-purine-2,6-dione, ... (5 entities in total)
• 機能のキーワード: dpp4, pyrimidinone, pyrimidindione, aminopeptidase, cell membrane, glycoprotein, hydrolase, membrane, protease, secreted, serine protease, signal-anchor, transmembrane, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
• 由来する生物種: Homo sapiens (Human)
• タンパク質・核酸の鎖数: 4
• 化学式量合計: 349435.68

構造登録者

Zhang, Z.,Wallace, M.B.,Feng, J.,Stafford, J.A.,Kaldor, S.W.,Shi, L.,Skene, R.J.,Aertgeerts, K.,Lee, B.,Jennings, A.,Xu, R.,Kassel, D.,Webb, D.R.,Gwaltney, S.L. (登録日: 2009-01-27, 公開日: 2010-02-16, 最終更新日: 2024-11-20)

主引用文献

Zhang, Z.,Wallace, M.B.,Feng, J.,Stafford, J.A.,Skene, R.J.,Shi, L.,Lee, B.,Aertgeerts, K.,Jennings, A.,Xu, R.,Kassel, D.B.,Kaldor, S.W.,Navre, M.,Webb, D.R.,Gwaltney, S.L.
Design and Synthesis of Pyrimidinone and Pyrimidinedione Inhibitors of Dipeptidyl Peptidase IV.
J.Med.Chem., 54:510-524, 2011

PubMed Abstract: The discovery of two classes of heterocyclic dipeptidyl peptidase IV (DPP-4) inhibitors, pyrimidinones and pyrimidinediones, is described. After a single oral dose, these potent, selective, and noncovalent inhibitors provide sustained reduction of plasma DPP-4 activity and lowering of blood glucose in animal models of diabetes. Compounds 13a, 27b, and 27j were selected for development.

PubMed: 21186796
DOI: 10.1021/jm101016w

実験手法

X-RAY DIFFRACTION (2.69 Å)