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Recognition of Errors in the Refinement and Validation of Three-Dimensional Structures of AC1 Proteins of Begomovirus Strains by Using ProSA-Web

机译:使用ProSA-Web识别和纯化大流行病毒株AC1蛋白三维结构中的错误

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The structural model of begomovirus AC1 protein is useful for understanding biological function at molecular level and docking study. For this study we have used the ProSA program (Protein Structure Analysis) tool to establish the structure prediction and modeling of protein. This tool was used for refinement and validation of experimental protein structures. Potential problems of protein structures based on energy plots are easily seen by ProSA and are displayed in a three-dimensional manner. In the present study we have selected different AC1 proteins of begomovirus strains (YP_003288785, YP_002004579, and YP_003288773) for structural analysis and display of energy plots that highlight potential problems spotted in protein structures. The 3D models of Rep proteins with recognized errors can be effectively used forin silicodocking study for development of potential ligand molecules against begomovirus infection.
机译:Begomovirus AC1蛋白的结构模型对于在分子水平了解生物学功能和对接研究很有用。在这项研究中,我们使用ProSA程序(蛋白质结构分析)工具来建立蛋白质的结构预测和建模。该工具用于完善和验证实验性蛋白质结构。 ProSA易于发现基于能量图的蛋白质结构的潜在问题,并以三维方式显示。在本研究中,我们选择了Begomovirus株的不同AC1蛋白(YP_003288785,YP_002004579和YP_003288773)进行结构分析和能量图显示,这些图突出了蛋白质结构中发现的潜在问题。具有识别错误的Rep蛋白的3D模型可以有效地用于计算机对接研究,以开发针对菜豆病毒感染的潜在配体分子。

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