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通过免疫信息学设计基于刺突蛋白(S蛋白)的针对SARS-CoV-2的多表位肽疫苗。

Designing spike protein (S-Protein) based multi-epitope peptide vaccine against SARS COVID-19 by immunoinformatics.

作者信息

Singh Hitesh, Jakhar Renu, Sehrawat Neelam

机构信息

Department of Genetics, Maharshi Dayanand University, Rohtak, Haryana India.

Centre for Biotechnology, Maharshi Dayanand University, Rohtak, Haryana India.

出版信息

Heliyon. 2020 Nov;6(11):e05528. doi: 10.1016/j.heliyon.2020.e05528. Epub 2020 Nov 16.

Abstract

The outbreak of COVID-19 was originated from China, responsible for Several Acute Respiratory Syndrome (SARS). Scientists are forced to develop vaccine and effective drugs to control COVID-19 infection. To develop effective vaccine for SARS - COVID 19, immunoinformatics and computational approaches could helps to design successful vaccine against this biggest danger for humanity. Here we used various approaches to designed vaccine against COVID-19. To develop vaccine, we target S- protein, expressed on the virus surface plays important role in COVID-19 infection. We identified 12 B-cell, 9 T-helper and 20 Cytotoxic T-cell epitope based on criteria of selection. The predicted epitopes were link simultaneously with GPGPG & AAY linkers. The β-defensin was used as adjuvant, linked with selected epitope by using EAAAK linker. For vaccine construct justification we analysed its immunogenicity, allergenicity and physiochemical properties. Our study revealed that vaccine was non toxic, immunogenic and antigenic in nature and covers 98.6% of world population, important for vaccine effectively cloning was used to analyse its expression in vector. Molecular docking was performed to study the interaction of construct with TLR (TLR3, TLR4, and TLR9) molecules. The immune simulation was conducted and conformed that our vaccine constructs can induces both acquired and humoral immunity effectively against COVID-19 at very low concentration, but along with bioinformatics study we need to conduct experiment in laboratory to validate its safety and effectiveness.

摘要

新冠病毒疫情起源于中国,它引发了几种急性呼吸综合征(SARS)。科学家们被迫研发疫苗和有效药物来控制新冠病毒感染。为了研发针对严重急性呼吸综合征冠状病毒2(SARS-CoV-19)的有效疫苗,免疫信息学和计算方法有助于设计出针对这一人类最大威胁的成功疫苗。在此,我们使用了多种方法来设计针对新冠病毒的疫苗。为了研发疫苗,我们将目标锁定在病毒表面表达的刺突蛋白(S蛋白),它在新冠病毒感染中起着重要作用。我们根据选择标准确定了12个B细胞表位、9个辅助性T细胞表位和20个细胞毒性T细胞表位。预测的表位通过GPGPG和AAY连接子同时连接起来。β-防御素被用作佐剂,通过EAAAK连接子与选定的表位相连。为了验证疫苗构建体的合理性,我们分析了其免疫原性、致敏性和理化性质。我们的研究表明,该疫苗本质上无毒、具有免疫原性和抗原性,覆盖了98.6%的世界人口,对疫苗有效克隆很重要,用于分析其在载体中的表达。进行了分子对接以研究构建体与Toll样受体(TLR,即TLR3、TLR4和TLR9)分子的相互作用。进行了免疫模拟并证实我们的疫苗构建体能够在非常低的浓度下有效诱导针对新冠病毒的获得性免疫和体液免疫,但除了生物信息学研究外,我们还需要在实验室进行实验以验证其安全性和有效性。

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