Structural Analysis of the Cu-binding Site in the [Cu·dCMP·dCMP-H] 1- Complex

Jung Sang-Mi; Kim Ho-Tae

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Structural Analysis of the Cu-binding Site in the [Cu·dCMP·dCMP-H] 1- Complex

机译：[Cu·dCMP·dCMP-H] 1-络合物中Cu结合位点的结构分析

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The Cu-binding site in the complex was investigated. The tandem mass (MS/MS) spectra of the [ parent ion showed fragment ions. Therefore, we propose that the Cu cation is simultaneously coordinated to the phosphate site and cytosine moiety in the stable geometry of the complex. Three geometries for the complex were considered in an attempt to optimize the structure of the complex. The ab initio calculations were performed at the level.

机译：研究了复合物中的铜结合位点。母离子的串联质谱（MS / MS）谱显示碎片离子。因此，我们建议在复合物的稳定几何形状中，将铜阳离子同时配位至磷酸位点和胞嘧啶部分。为了优化复合物的结构，考虑了复合物的三种几何形状。从头算是在该级别上进行的。

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《Mass Spectrometry Letters》 |2013年第4期|共4页
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Jung Sang-Mi; Kim Ho-Tae;
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Structural Analysis of the Cu-binding Site in the [Cu·dCMP·dCMP-H] 1- Complex

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