In silico EsxG EsxH rational epitope selection: Candidate epitopes for vaccine design against pulmonary tuberculosis.
Constanza Estefania Martinez-Olivares, Rogelio Hernández-Pando, Edgar Mixcoha
Journal: PloS one
2023;18(4):e0284264
PMID: 37079575
Abstract
["Rational design of new vaccines against pulmonary tuberculosis is imperative. Early secreted antigens (Esx) G and H are involved in metal uptake, drug resistance, and immune response evasion. These characteristics make it an ideal target for rational vaccine development. The aim of this study is to show the rational design of epitope-based peptide vaccines by using bioinformatics and structural vaccinology tools. A total of 4.15 \u03bcs of Molecular Dynamics simulations were carried out to describe the behavior in solution of heterodimer, single epitopes, and epitopes loaded into MHC-II complexes. In order to predict T and B cell epitopes for antigenic activation, bioinformatic tools were used. Hence, we propose three epitopes with the potential to design pulmonary tuberculosis vaccines. The possible use of the proposed epitopes includes subunit vaccines, as a booster in BCG vaccination to improve its immune response, as well as the generation of antibodies that interfere with the Mycobacterium tuberculosis homeostasis, affecting its survival.",{"copyright":"Copyright: \u00a9 2023 Martinez-Olivares et al. This is an open access article distributed under the terms of the Creative Commons Attribution License, which permits unrestricted use, distribution, and reproduction in any medium, provided the original author and source are credited."}]
Address:
Experimental Pathology Department, Experimental Pathology Laboratory, Instituto Nacional de Ciencias Médicas y Nutrición "Salvador Zubirán", Mexico City, Mexico.; Facultad de Medicina, Pathology Department, Universidad Nacional Autónoma de México, Mexico City, Mexico.; Addiction Immunology Laboratory, Instituto Nacional de Psiquiatría "Ramón de la Fuente Muñiz"-CONACyT, Mexico City, Mexico.; Faculty of Sciences, Cellular Biology Department, Universidad Nacional Autónoma de México, Mexico City, Mexico.
Link outs
Free resources
Full Text Sources:
Research Materials:
MeSH Terms:
Humans,
Tuberculosis, Pulmonary,
Mycobacterium tuberculosis,
Metals,
Epitopes, B-Lymphocyte,
Vaccine Development,
Epitopes, T-Lymphocyte,
Computational Biology,
Vaccines, Subunit,
Molecular Docking Simulation