3KX1

Cathepsin K in complex with a selective 2-cyano-pyrimidine inhibitor

3KX1 の概要

• エントリーDOI: 10.2210/pdb3kx1/pdb
• 関連するPDBエントリー: 3KWZ
• 分子名称: Cathepsin K, 4-cycloheptyl-6-(3-piperidin-1-ylpropyl)pyrimidine-2-carbonitrile, SULFATE ION, ... (4 entities in total)
• 機能のキーワード: cathepsin k, enzyme inhibitor, covalent reversible inhibitor, disease mutation, disulfide bond, glycoprotein, hydrolase, lysosome, protease, thiol protease, zymogen
• 由来する生物種: Homo sapiens (human)
• 細胞内の位置: Lysosome: P43235
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 24042.08

構造登録者

Fradera, X.,Uitdehaag, J.C.M.,van Zeeland, M. (登録日: 2009-12-02, 公開日: 2010-03-02, 最終更新日: 2024-04-03)

• 主引用文献: Rankovic, Z.,Cai, J.,Kerr, J.,Fradera, X.,Robinson, J.,Mistry, A.,Hamilton, E.,McGarry, G.,Andrews, F.,Caulfield, W.,Cumming, I.,Dempster, M.,Waller, J.,Scullion, P.,Martin, I.,Mitchell, A.,Long, C.,Baugh, M.,Westwood, P.,Kinghorn, E.,Bruin, J.,Hamilton, W.,Uitdehaag, J.,van Zeeland, M.,Potin, D.,Saniere, L.,Fouquet, A.,Chevallier, F.,Deronzier, H.,Dorleans, C.,Nicolai, E.; Design and optimization of a series of novel 2-cyano-pyrimidines as cathepsin K inhibitors; Bioorg.Med.Chem.Lett., 20:1524-1527, 2010; PubMed: 20149657; DOI: 10.1016/j.bmcl.2010.01.100

実験手法

X-RAY DIFFRACTION (1.51 Å)