化学
半胱氨酸
丝氨酸
信号转导衔接蛋白
赖氨酸
加合物
酪氨酸
双功能
共价键
KEAP1型
谷胱甘肽
氨基酸
立体化学
精氨酸
生物化学
磷酸化
酶
有机化学
催化作用
基因
转录因子
作者
Xiaoli Meng,J. Waddington,Arun Tailor,Adam Lister,Jane Hamlett,Neil G. Berry,B. Kevin Park,Michael B. Sporn
标识
DOI:10.1021/acs.jmedchem.0c01088
摘要
Synthetic triterpenoids including CDDO, its methyl ester (CDDO-Me, bardoxolone methyl), and its imidazolide (CDDO-Im) enhance Nrf2-mediated antioxidant and anti-inflammatory activity in many diseases by reacting with thiols on the adaptor protein, Keap1. Unlike monofunctional CDDO-Me, the bifunctional analog, CDDO-Im, has a second reactive site (imidazolide) and can covalently bind to amino acids other than cysteine on target proteins such as glutathione S-transferase pi (GSTP), serum albumin, or Keap1. Here we show for the first time that bifunctional CDDO-Im (in contrast to CDDO-Me), as low as 50 nM, can covalently transacylate arginine and serine residues in GSTP and cross-link them to adjacent cysteine residues. Moreover, we show that CDDO-Im binds covalently to Keap1 by forming permanent Michael adducts with eight different cysteines, and acyl adducts with lysine and several tyrosine residues. Modeling studies suggest that the Tyr 85 adduct stabilizes the Keap1-Cul3 complex, thereby enhancing the potency of CDDO-Im.
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