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DeepDN_iGlu:基于注意力残差学习方法和 DenseNet 的赖氨酸瓜氨酸化位点预测。

DeepDN_iGlu: prediction of lysine glutarylation sites based on attention residual learning method and DenseNet.

机构信息

School of Information Engineering, Jingdezhen Ceramic University, Jingdezhen 333403, China.

出版信息

Math Biosci Eng. 2023 Jan;20(2):2815-2830. doi: 10.3934/mbe.2023132. Epub 2022 Dec 1.

Abstract

As a key issue in orchestrating various biological processes and functions, protein post-translational modification (PTM) occurs widely in the mechanism of protein's function of animals and plants. Glutarylation is a type of protein-translational modification that occurs at active ε-amino groups of specific lysine residues in proteins, which is associated with various human diseases, including diabetes, cancer, and glutaric aciduria type I. Therefore, the issue of prediction for glutarylation sites is particularly important. This study developed a brand-new deep learning-based prediction model for glutarylation sites named DeepDN_iGlu via adopting attention residual learning method and DenseNet. The focal loss function is utilized in this study in place of the traditional cross-entropy loss function to address the issue of a substantial imbalance in the number of positive and negative samples. It can be noted that DeepDN_iGlu based on the deep learning model offers a greater potential for the glutarylation site prediction after employing the straightforward one hot encoding method, with Sensitivity (Sn), Specificity (Sp), Accuracy (ACC), Mathews Correlation Coefficient (MCC), and Area Under Curve (AUC) of 89.29%, 61.97%, 65.15%, 0.33 and 0.80 accordingly on the independent test set. To the best of the authors' knowledge, this is the first time that DenseNet has been used for the prediction of glutarylation sites. DeepDN_iGlu has been deployed as a web server (https://bioinfo.wugenqiang.top/~smw/DeepDN_iGlu/) that is available to make glutarylation site prediction data more accessible.

摘要

作为调控各种生物过程和功能的关键问题,蛋白质翻译后修饰(PTM)广泛存在于动植物蛋白质功能的机制中。谷氨酰化是一种蛋白质翻译后修饰,发生在蛋白质中特定赖氨酸残基的活性 ε-氨基上,与包括糖尿病、癌症和 I 型戊二酸尿症在内的各种人类疾病有关。因此,预测谷氨酰化位点的问题尤为重要。本研究通过采用注意力残差学习方法和 DenseNet 开发了一种全新的基于深度学习的谷氨酰化位点预测模型,名为 DeepDN_iGlu。本研究采用焦点损失函数替代传统的交叉熵损失函数,解决了正负样本数量极不平衡的问题。可以注意到,基于深度学习模型的 DeepDN_iGlu 在采用简单的 one hot 编码方法后,对谷氨酰化位点的预测具有更大的潜力,在独立测试集上的敏感性(Sn)、特异性(Sp)、准确性(ACC)、马修斯相关系数(MCC)和曲线下面积(AUC)分别为 89.29%、61.97%、65.15%、0.33 和 0.80。据作者所知,这是首次将 DenseNet 用于谷氨酰化位点的预测。DeepDN_iGlu 已作为一个网络服务器(https://bioinfo.wugenqiang.top/~smw/DeepDN_iGlu/)部署,用于使谷氨酰化位点预测数据更易获取。

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