用于表征白消安代谢物EdAG及其加合物谷氧还蛋白的支持数据。
Supporting data for characterization of the busulfan metabolite EdAG and the Glutaredoxins that it adducts.
作者信息
Scian Michele, Atkins William M
机构信息
Department of Medicinal Chemistry, University of Washington, United States.
出版信息
Data Brief. 2015 Sep 10;5:161-70. doi: 10.1016/j.dib.2015.09.002. eCollection 2015 Dec.
This article describes data related to a research article titled "The Busulfan Metabolite EdAG Irreversibly Glutathionylates Glutaredoxins" [1]. EdAG is an electrophilic GSH analog formed in vivo from busulfan, which is used in hematopoietic stem cell transplants. EdAG glutathionylates Glutaredoxins (Grx's) but not glutathione transferase A1-1 (GSTA1-1) in vitro. This article includes a complete NMR characterization of synthetic EdAG including homonuclear and heteronuclear correlation spectra. Also included are mass spectra of peptides from Grx's or GSTA1-1 that have cys residues that do not react with EdAG.
本文描述了与一篇题为《白消安代谢物EdAG不可逆地谷胱甘肽化谷氧还蛋白》[1]的研究文章相关的数据。EdAG是一种在体内由用于造血干细胞移植的白消安形成的亲电子谷胱甘肽类似物。在体外，EdAG能使谷氧还蛋白（Grx's）发生谷胱甘肽化反应，但不能使谷胱甘肽转移酶A1-1（GSTA1-1）发生谷胱甘肽化反应。本文包括合成EdAG的完整核磁共振表征，包括同核和异核相关光谱。还包括来自Grx's或GSTA1-1的肽段的质谱，这些肽段含有不与EdAG反应的半胱氨酸残基。
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