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首页> 外文期刊>Journal of Bioinformatics and Computational Biology >Improved sequence-based prediction of strand residues
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Improved sequence-based prediction of strand residues

机译:改进的基于序列的链残基预测

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Accurate identification of strand residues aids prediction and analysis of numerous structural and functional aspects of proteins. We propose a sequence-based predictor, BETArPRED, which improves prediction of strand residues and β-strand segments. BETArPRED uses a novel design that accepts strand residues predicted by SSpro and predicts the remaining positions utilizing a logistic regression classifier with nine custom-designed features. These are derived from the primary sequence, the secondary structure (SS) predicted by SSpro, PSIPRED and SPINE, and residue depth as predicted by RDpred. Our features utilize certain local (window-based) patterns in the predicted SS and combine information about the predicted SS and residue depth. BETArPRED is evaluated on 432 sequences that share low identity with the training chains, and on the CASP8 dataset. We compare BETArPRED with seven modern SS predictors, and the top-performing automated structure predictor in CASP8, the ZHANG-server. BETArPRED provides statistically significant improvements over each of the SS predictors; it improves prediction of strand residues and β-strands, and it finds β-strands that were missed by the other methods. When compared with the ZHANG-server, we improve predictions of strand segments and predict more actual strand residues, while the other predictor achieves higher rate of correct strand residue predictions when under-predicting them.
机译:准确鉴定链残基有助于预测和分析蛋白质的许多结构和功能方面。我们提出了一种基于序列的预测子BETArPRED,可改善对链残基和β链段的预测。 BETArPRED使用新颖的设计,可以接受SSpro预测的链残基,并利用具有9种自定义设计功能的逻辑回归分类器预测剩余位置。这些来自一级序列,SSpro,PSIPRED和SPINE预测的二级结构(SS),以及RDpred预测的残基深度。我们的功能利用预测的SS中的某些局部(基于窗口的)模式,并结合有关预测的SS和残渣深度的信息。对与训练链共享同一性低的432个序列和CASP8数据集评估BETArPRED。我们将BETArPRED与七个现代SS预测器以及ZHANG服务器CASP8中性能最高的自动化结构预测器进行了比较。 BETArPRED在统计上比每个SS预测指标都有显着改善;它改善了对链残基和β链的预测,并发现了其他方法遗漏的β链。与ZHANG服务器相比,我们改进了链段的预测并预测了更多实际的链残基,而其他预测变量在预测不足时获得了更高的正确链残基预测率。

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