6BG5

Structure of 1-(benzo[d][1,3]dioxol-5-ylmethyl)-1-(1-propylpiperidin-4-yl)-3-(3-(trifluoromethyl)phenyl)urea bound to DCN1

6BG5 の概要

• エントリーDOI: 10.2210/pdb6bg5/pdb
• 分子名称: Endolysin, DCN1-like protein 1 chimera, N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(1-propylpiperidin-4-yl)-N'-[3-(trifluoromethyl)phenyl]urea (3 entities in total)
• 機能のキーワード: e3 ligase, hydrolase, ligase-inhibitor complex, ligase/inhibitor
• 由来する生物種: Enterobacteria phage T4; 詳細
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 44770.85

構造登録者

Guy, R.K.,Schulman, B.A.,Scott, D.C.,Hammill, J.T. (登録日: 2017-10-27, 公開日: 2018-09-26, 最終更新日: 2023-10-04)

• 主引用文献: Hammill, J.T.,Scott, D.C.,Min, J.,Connelly, M.C.,Holbrook, G.,Zhu, F.,Matheny, A.,Yang, L.,Singh, B.,Schulman, B.A.,Guy, R.K.; Piperidinyl Ureas Chemically Control Defective in Cullin Neddylation 1 (DCN1)-Mediated Cullin Neddylation.; J. Med. Chem., 61:2680-2693, 2018; PubMed: 29547696; DOI: 10.1021/acs.jmedchem.7b01277

実験手法

X-RAY DIFFRACTION (1.1 Å)