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Evaluating the accuracy of SHAPE-directed RNA secondary structure predictions

机译:评估SHAPE指导的RNA二级结构预测的准确性

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摘要

Recent advances in RNA structure determination include using data from high-throughput probing experiments to improve thermodynamic prediction accuracy. We evaluate the extent and nature of improvements in data-directed predictions for a diverse set of 16S/18S ribosomal sequences using a stochastic model of experimental SHAPE data. The average accuracy for 1000 data-directed predictions always improves over the original minimum free energy (MFE) structure. However, the amount of improvement varies with the sequence, exhibiting a correlation with MFE accuracy. Further analysis of this correlation shows that accurate MFE base pairs are typically preserved in a data-directed prediction, whereas inaccurate ones are not. Thus, the positive predictive value of common base pairs is consistently higher than the directed prediction accuracy. Finally, we confirm sequence dependencies in the directability of thermodynamic predictions and investigate the potential for greater accuracy improvements in the worst performing test sequence.
机译:RNA结构测定的最新进展包括使用来自高通量探测实验的数据来提高热力学预测准确性。我们使用实验的SHAPE数据的随机模型,评估了数据导向的预测的多样性和16S / 18S核糖体序列的多样化集的性质。 1000个以数据为导向的预测的平均准确度始终会超过原始的最小自由能(MFE)结构。但是,改进的程度随序列而变化,表现出与MFE精度的相关性。对这种相关性的进一步分析表明,准确的MFE碱基对通常保留在以数据为导向的预测中,而不准确的碱基对则没有。因此,公共碱基对的正预测值始终高于定向预测精度。最后,我们在热力学预测的可定向性中确认了序列依赖性,并研究了在性能最差的测试序列中更大准确性提高的潜力。

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