Epitope-Based Immunoinformatics Approach on Nucleocapsid Protein of Severe Acute Respiratory Syndrome-Coronavirus-2

Molecules. 2020 Nov 2;25(21):5088. doi: 10.3390/molecules25215088.

Abstract

With an increasing fatality rate, severe acute respiratory syndrome-coronavirus-2 (SARS-CoV-2) has emerged as a promising threat to human health worldwide. Recently, the World Health Organization (WHO) has announced the infectious disease caused by SARS-CoV-2, which is known as coronavirus disease-2019 (COVID-2019), as a global pandemic. Additionally, the positive cases are still following an upward trend worldwide and as a corollary, there is a need for a potential vaccine to impede the progression of the disease. Lately, it has been documented that the nucleocapsid (N) protein of SARS-CoV-2 is responsible for viral replication and interferes with host immune responses. We comparatively analyzed the sequences of N protein of SARS-CoV-2 for the identification of core attributes and analyzed the ancestry through phylogenetic analysis. Subsequently, we predicted the most immunogenic epitope for the T-cell and B-cell. Importantly, our investigation mainly focused on major histocompatibility complex (MHC) class I potential peptides and NTASWFTAL interacted with most human leukocyte antigen (HLA) that are encoded by MHC class I molecules. Further, molecular docking analysis unveiled that NTASWFTAL possessed a greater affinity towards HLA and also available in a greater range of the population. Our study provides a consolidated base for vaccine design and we hope that this computational analysis will pave the way for designing novel vaccine candidates.

Keywords: COVID-19; SARS-CoV-2; bioinformatics; epitope; immunoinformatics; nucleocapsid protein; vaccine.

MeSH terms

  • Amino Acid Sequence
  • Betacoronavirus / immunology*
  • CD8-Positive T-Lymphocytes / immunology
  • COVID-19 Vaccines
  • Coronavirus Infections / immunology
  • Coronavirus Infections / prevention & control
  • Coronavirus Nucleocapsid Proteins
  • Drug Hypersensitivity / immunology
  • Epitopes, B-Lymphocyte / immunology
  • Epitopes, T-Lymphocyte / immunology
  • Histocompatibility Antigens Class I
  • Humans
  • Models, Molecular
  • Molecular Docking Simulation
  • Nucleocapsid Proteins / chemistry
  • Nucleocapsid Proteins / immunology*
  • Peptide Fragments / immunology
  • Phosphoproteins
  • Protein Structure, Secondary
  • SARS-CoV-2
  • Viral Vaccines / immunology

Substances

  • COVID-19 Vaccines
  • Coronavirus Nucleocapsid Proteins
  • Epitopes, B-Lymphocyte
  • Epitopes, T-Lymphocyte
  • Histocompatibility Antigens Class I
  • Nucleocapsid Proteins
  • Peptide Fragments
  • Phosphoproteins
  • Viral Vaccines
  • nucleocapsid phosphoprotein, SARS-CoV-2