Reuter Henrik, Steinritz Dirk, Worek Franz, John Harald
Bundeswehr Institute of Pharmacology and Toxicology, Neuherbergstr. 11, 80937, Munich, Germany.
Anal Bioanal Chem. 2025 Apr;417(9):1833-1845. doi: 10.1007/s00216-025-05762-x. Epub 2025 Feb 1.
Pronase-catalyzed proteolysis is shown to produce single amino acid adducts of tyrosine (Tyr) and cysteine (Cys) obtained from both human serum albumin (HSA) and immunoglobulin G (IgG) after in vitro exposure of plasma to the nerve agent VX. Total plasma as well as isolated HSA and IgG yielded the Tyr residue phosphonylated with the ethyl methylphosphonic acid moiety, Tyr(-EMP). Furthermore, a Cys residue adducted with the diisopropylaminoethane thiol leaving group of the agent bound via a disulfide bridge, Cys(-DPAET), was also obtained from both proteins. Even though Tyr(-EMP) represents an internationally well-accepted biomarker of a VX-like agent its origin from plasma IgG has never been shown before. In addition, this is the first time that Cys(-DPAET) is presented as a biomarker of VX exposure clearly identifying the chemical nature of the V-type nerve agent's leaving group. Both biomarkers were detected after selective affinity-based solid-phase extraction (SPE) from plasma that yielded highly purified HSA and IgG as documented by sodium dodecyl polyamide gel electrophoresis (SDS-PAGE). Both biomarkers were found in the corresponding protein bands of HSA and IgG each after in-gel proteolysis with pronase. A micro liquid chromatography-electrospray ionization high-resolution tandem-mass spectrometry method (LC-ESI HR-MS/MS) was developed for the simultaneous detection of Tyr(-EMP) and Cys(-DPAET). The time for proteolysis was optimized for maximum biomarker yield. The method showed excellent selectivity and sensitivity, and the adducted proteins and biomarkers were found to be highly stable during storage. Accordingly, the presented method sheds more light on the molecular toxicology of VX and broadens the spectrum of methods suited for biomedical verification.
在体外将血浆暴露于神经毒剂VX后,已证明链霉蛋白酶催化的蛋白水解作用会产生来自人血清白蛋白(HSA)和免疫球蛋白G(IgG)的酪氨酸(Tyr)和半胱氨酸(Cys)的单氨基酸加合物。总血浆以及分离出的HSA和IgG均产生了被乙基甲基膦酸部分膦酰化的Tyr残基,即Tyr(-EMP)。此外,还从这两种蛋白质中获得了一个Cys残基,该残基与通过二硫键结合的该药剂的二异丙基氨基乙硫醇离去基团加合,即Cys(-DPAET)。尽管Tyr(-EMP)是一种国际上公认的类VX药剂的生物标志物,但其源自血浆IgG的情况此前从未得到证实。此外,这是首次将Cys(-DPAET)作为VX暴露的生物标志物呈现,它明确地确定了V型神经毒剂离去基团的化学性质。通过基于选择性亲和的固相萃取(SPE)从血浆中检测到了这两种生物标志物,该方法产生了经十二烷基聚丙烯酰胺凝胶电泳(SDS-PAGE)证明的高度纯化的HSA和IgG。在用链霉蛋白酶进行凝胶内蛋白水解后,在HSA和IgG各自相应的蛋白条带中都发现了这两种生物标志物。开发了一种微液相色谱 - 电喷雾电离高分辨率串联质谱法(LC-ESI HR-MS/MS)用于同时检测Tyr(-EMP)和Cys(-DPAET)。对蛋白水解时间进行了优化以实现最大生物标志物产量。该方法显示出优异的选择性和灵敏度,并且加合的蛋白质和生物标志物在储存期间被发现具有高度稳定性。因此,所提出的方法为VX的分子毒理学提供了更多信息,并拓宽了适用于生物医学验证的方法范围。