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Gas-phase hydration of Mg2+ complexes with deprotonated uracil, thymine, uridine, and thymidine.
Journal of Mass Spectrometry ( IF 2.3 ) Pub Date : 2020-02-11 , DOI: 10.1002/jms.4504
Magdalena Frańska 1 , Anna Michalak 1 , Łukasz Ławniczak 2
Affiliation  

The gas-phase hydration of Mg2+ complexes with deprotonated uracil (U), thymine (T), uridine (Ur , uracil riboside), and thymidine (Tdr , thymine deoxyriboside) was studied. The aim of the work was to analyze the hydration of product ions (eg, [2U-H+Mg]+ ) formed as a result of the collision induced dissociation of the respective parent ion (eg, [3Ur -H+Mg]+ ). The efficiency of gas-phase hydration of the ions [2U-H+Mg]+ and [2T-H+Mg]+ was similar. However, the efficiency of gas-phase hydration of the ion [U+Ur -H+Mg]+ was much higher than that of gas-phase hydration of the ion [T+Tdr -H+Mg]+ . On the basis of the mass spectra obtained and the performed molecular modelling, it was concluded that in the ion [T+Tdr -H+Mg]+ , we deal with a steric hindrance due to the presence of a sugar moiety, which affects water attachment. In the ion [U+Ur -H+Mg]+ , the position of the sugar moiety does not affect water attachment.

中文翻译:

Mg2 +配合物与去质子化的尿嘧啶,胸腺嘧啶,尿苷和胸苷的气相水合。

研究了Mg2 +与去质子化尿嘧啶(U),胸腺嘧啶(T),尿苷(Ur,尿嘧啶核糖苷)和胸苷(Tdr,胸腺嘧啶脱氧核糖苷)的气相水合。这项工作的目的是分析由于母离子碰撞引起的离解(例如[3Ur -H + Mg] +)而形成的产物离子(例如[2U-H + Mg] +)的水合)。离子[2U-H + Mg] +和[2T-H + Mg] +的气相水合效率相似。然而,离子[U + Ur -H + Mg] +的气相水合效率远高于离子[T + Tdr -H + Mg] +的气相水合效率。根据获得的质谱图和进行的分子建模,得出的结论是,在离子[T + Tdr -H + Mg] +中,我们处理了由于存在糖分而影响水的空间位阻附件。
更新日期:2020-02-11
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