Structural and functional characterization of SARS-CoV-2 nucleocapsid protein mutations identified in Turkey by using in silico approaches.

IF 1.1 4区 医学 Q4 VIROLOGY Acta virologica Pub Date : 2023-01-01 DOI:10.4149/av_2023_106
Betul Akcesme, Burcin Erkal, Zehra Yaren Donmez
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Abstract

Missense mutations in the severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2) virus may cause changes in the structure of proteins. The nucleocapsid (N) protein is an important target for drugs and vaccines. The main purpose of this study is to detect missense mutations in the SARS-CoV-2 N protein and to reveal the effects of these mutations on protein structure by using in silico approaches. 161 missense mutations of the N protein were determined in 2286 SARS-CoV-2 genomes derived from the GISAID EpiCoV database in the Turkish population. Identified 161 missense mutations were analyzed by using sequence and structure-based methods to predict effects of mutation on function and structure of SARS-CoV-2 N protein. These analyzes revealed that some mutations showed deleterious effects and change of stability and flexibility of nucleocapsid protein. D3L, S194L, S235F, and P13L (Omicron variant) mutations were further analyzed in our study due to their importance in the literature and in our results. Even though, our findings are essential for research of SARS-CoV-2 virus, in vitro and in vivo validations are necessary. Keywords: nucleocapsid protein; SARS-CoV-2; missense mutations; protein stability; protein flexibility.

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利用计算机方法在土耳其鉴定出的SARS-CoV-2核衣壳蛋白突变的结构和功能特征
严重急性呼吸综合征冠状病毒2 (SARS-CoV-2)病毒的错义突变可能导致蛋白质结构的改变。核衣壳蛋白(N)是药物和疫苗的重要靶点。本研究的主要目的是通过计算机方法检测sars - cov - 2n蛋白的错义突变,并揭示这些突变对蛋白质结构的影响。在来自GISAID EpiCoV数据库的2286个土耳其人群SARS-CoV-2基因组中检测到161个N蛋白错义突变。采用基于序列和结构的方法对鉴定出的161个错义突变进行分析,预测突变对sars - cov - 2n蛋白功能和结构的影响。这些分析表明,一些突变表现出有害影响,并改变了核衣壳蛋白的稳定性和灵活性。由于D3L、S194L、S235F和P13L (Omicron variant)突变在文献和我们的结果中的重要性,我们在研究中进一步分析了它们。尽管我们的发现对SARS-CoV-2病毒的研究至关重要,但体外和体内验证是必要的。关键词:核衣壳蛋白;SARS-CoV-2;错义突变;蛋白质的稳定性;蛋白质的灵活性。
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来源期刊
Acta virologica
Acta virologica 医学-病毒学
CiteScore
3.10
自引率
11.80%
发文量
43
审稿时长
>12 weeks
期刊介绍: Acta virologica is an international journal of predominantly molecular and cellular virology. Acta virologica aims to publish papers reporting original results of fundamental and applied research mainly on human, animal and plant viruses at cellular and molecular level. As a matter of tradition, also rickettsiae are included. Areas of interest are virus structure and morphology, molecular biology of virus-cell interactions, molecular genetics of viruses, pathogenesis of viral diseases, viral immunology, vaccines, antiviral drugs and viral diagnostics.
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