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UniQua: A Universal Signal Processor for MS-Based Qualitative and Quantitative Proteomics Applications

机译:UniQua:用于基于MS的定性和定量蛋白质组学应用的通用信号处理器

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摘要

Recent developments in high resolution mass spectrometry (HR-MS) technology have ushered proteomics into a new era. However, the importance of using a common, open data platform for signal processing of HR-MS spectra has not been sufficiently addressed. In this study, a MS signal processor was developed to facilitate data integration from different instruments and different proteomics approaches into a unified platform without compromising protein identification and quantitation performance. This processor supports parallel processing capability which allows full utilization of computing resources to speed up signal processing performance to >1 gigabytes/min. The storage space occupied by the processed MS data can be reduced to ~10%, which helps the analysis and management of large quantities of data from comprehensive proteomics studies. For quantitation at the MS level, processing accuracy is improved and processing time for ASAPRatio is reduced to ~50%. For quantitation at the MS/MS level, accurate reporter ion ratios from different instruments can be directly determined by the processed MS/MS spectra and reported in the Mascot search result directly without using specialized iTRAQ software.
机译:高分辨率质谱(HR-MS)技术的最新发展将蛋白质组学带入了一个新时代。但是,使用通用的开放数据平台进行HR-MS光谱信号处理的重要性尚未得到充分解决。在这项研究中,开发了一种MS信号处理器,以促进将不同仪器和不同蛋白质组学方法的数据整合到一个统一的平台中,而不会影响蛋白质的鉴定和定量性能。该处理器支持并行处理功能,该功能允许充分利用计算资源,以将信号处理性能加速至> 1 GB / min。经过处理的MS数据所占的存储空间可以减少到约10%,这有助于从综合蛋白质组学研究中分析和管理大量数据。对于MS级定量,可以提高处理精度,并且ASAPRatio的处理时间可以减少到〜50%。为了在MS / MS级别进行定量,可以通过处理的MS / MS光谱直接确定来自不同仪器的准确报告离子比率,并直接在Mascot搜索结果中报告,而无需使用专门的iTRAQ软件。

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