尿素和二甲基亚砜诱导DhaA变性的分子动力学模拟
郑禾1(
),杨盛江2,郑永超1,崔燕1,郭旋1,钟近艺1(),周健2()
),杨盛江2,郑永超1,崔燕1,郭旋1,钟近艺1(),周健2()
Molecular dynamics simulation of denaturation of DhaA induced by urea and dimethyl sulfoxide
He ZHENG1(),Shengjiang YANG2,Yongchao ZHENG1,Yan CUI1,Xuan GUO1,Jinyi ZHONG1(),Jian ZHOU2()
),Shengjiang YANG2,Yongchao ZHENG1,Yan CUI1,Xuan GUO1,Jinyi ZHONG1(),Jian ZHOU2()
图5. DhaA在不同模拟体系中的氢键数（蓝色表示DhaA与水分子氢键，红色表示DhaA与有机分子氢键，黑色表示DhaA分子内氢键）
Fig.5. Numbers of H-bonds in DhaA in simulation systems
(blue bar represents H-bond between DhaA and water molecules, red bar represents H-bond between DhaA and organic molecules, black bar represents intramolecular H-bond of DhaA molecules)
