3BWJ

Complex of PKA with the bisubstrate protein kinase inhibitor lead compound Arc-1034

3BWJ の概要

• エントリーDOI: 10.2210/pdb3bwj/pdb
• 関連するBIRD辞書のPRD_ID: PRD_000645
• 分子名称: cAMP-dependent protein kinase, alpha-catalytic subunit, (2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-N-(6-{[(1R)-4-carbamimidamido-1-{[(1R)-4-carbamimidamido-1-carbamoylbutyl]carbamoyl}butyl]amino}-6-oxohexyl)-3,4-dihydroxytetrahydrofuran-2-carboxamide (3 entities in total)
• 機能のキーワード: bisubstrate inhibitor, protein kinase, serine/threonine-protein kinase, atp-binding, camp, phosphoprotein, transferase-transferase inhibitor complex, transferase/transferase inhibitor
• 由来する生物種: Bos taurus (bovine)
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 42197.93

構造登録者

Lavogina, D.,Koenig, N.,Uri, A.,Bossemeyer, D. (登録日: 2008-01-09, 公開日: 2009-02-03, 最終更新日: 2019-09-04)

• 主引用文献: Lavogina, D.,Lust, M.,Viil, I.,Konig, N.,Raidaru, G.,Rogozina, J.,Enkvist, E.,Uri, A.,Bossemeyer, D.; Structural analysis of ARC-type inhibitor (ARC-1034) binding to protein kinase A catalytic subunit and rational design of bisubstrate analogue inhibitors of basophilic protein kinases.; J.Med.Chem., 52:308-321, 2009; PubMed: 19143565; DOI: 10.1021/jm800797n

実験手法

X-RAY DIFFRACTION (2.3 Å)