Xue Yu, Chen Hu, Jin Changjiang, Sun Zhirong, Yao Xuebiao
Laboratory of Cellular Dynamics, Hefei National Laboratory for Physical Sciences, and the University of Science and Technology of China, Hefei, China.
BMC Bioinformatics. 2006 Oct 17;7:458. doi: 10.1186/1471-2105-7-458.
Protein palmitoylation, an essential and reversible post-translational modification (PTM), has been implicated in cellular dynamics and plasticity. Although numerous experimental studies have been performed to explore the molecular mechanisms underlying palmitoylation processes, the intrinsic feature of substrate specificity has remained elusive. Thus, computational approaches for palmitoylation prediction are much desirable for further experimental design.
In this work, we present NBA-Palm, a novel computational method based on Naïve Bayes algorithm for prediction of palmitoylation site. The training data is curated from scientific literature (PubMed) and includes 245 palmitoylated sites from 105 distinct proteins after redundancy elimination. The proper window length for a potential palmitoylated peptide is optimized as six. To evaluate the prediction performance of NBA-Palm, 3-fold cross-validation, 8-fold cross-validation and Jack-Knife validation have been carried out. Prediction accuracies reach 85.79% for 3-fold cross-validation, 86.72% for 8-fold cross-validation and 86.74% for Jack-Knife validation. Two more algorithms, RBF network and support vector machine (SVM), also have been employed and compared with NBA-Palm.
Taken together, our analyses demonstrate that NBA-Palm is a useful computational program that provides insights for further experimentation. The accuracy of NBA-Palm is comparable with our previously described tool CSS-Palm. The NBA-Palm is freely accessible from: http://www.bioinfo.tsinghua.edu.cn/NBA-Palm.
蛋白质棕榈酰化是一种重要的可逆翻译后修饰(PTM),与细胞动力学和可塑性有关。尽管已经进行了大量实验研究来探索棕榈酰化过程的分子机制,但底物特异性的内在特征仍然难以捉摸。因此,用于棕榈酰化预测的计算方法对于进一步的实验设计非常有必要。
在这项工作中,我们提出了NBA-Palm,一种基于朴素贝叶斯算法的新型计算方法,用于预测棕榈酰化位点。训练数据来自科学文献(PubMed),在去除冗余后,包括来自105种不同蛋白质的245个棕榈酰化位点。潜在棕榈酰化肽的合适窗口长度优化为六个。为了评估NBA-Palm的预测性能,进行了3折交叉验证、8折交叉验证和留一法验证。3折交叉验证的预测准确率达到85.79%,8折交叉验证的预测准确率达到86.72%,留一法验证的预测准确率达到86.74%。还采用了另外两种算法,径向基函数网络(RBF网络)和支持向量机(SVM),并与NBA-Palm进行了比较。
综上所述,我们的分析表明NBA-Palm是一个有用的计算程序,为进一步的实验提供了见解。NBA-Palm的准确性与我们之前描述的工具CSS-Palm相当。可从以下网址免费访问NBA-Palm:http://www.bioinfo.tsinghua.edu.cn/NBA-Palm。