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鲍曼不动杆菌中AsaA VI型分泌系统免疫显性表位肽的预测:一种计算方法

Predictions of Immunodominant Epitope Peptides From the AsaA Type VI Secretion System in Acinetobacter baumannii: A Computational Approach.

作者信息

Ranjan Medha, Girija A S Smiline, Priyadharsini Vijayashree J

机构信息

Department of Microbiology, Saveetha Dental College and Hospitals, Saveetha Institute of Medical and Technical Sciences, Saveetha University, Chennai, IND.

出版信息

Cureus. 2024 May 4;16(5):e59618. doi: 10.7759/cureus.59618. eCollection 2024 May.

DOI:10.7759/cureus.59618
PMID:38832200
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC11146464/
Abstract

Introduction , designated as a priority pathogen by the World Health Organization (WHO), is responsible for recalcitrant infections in immunocompromised patients. The type VI secretion system (T6SS) is a class of macromolecular secretion machines, contributing to its virulence. The aim of this study is thus to predict the immune-dominant epitope peptides from the Acinetobacter T6SS-associated protein of  (AsaA). Methods AsaA protein retrieval from the bacteria was carried out using computational platforms and the evaluation of antigenicity and allergenicity was performed. The T-cell epitopes of major histocompatibility complex class II binders were identified followed by molecular docking of the immune-dominant epitopes with human leukocyte antigen alleles using the ClusterPro server (https://cluspro.org/help.php). Additionally, the B-cell epitopes were predicted. Results Immune-informatic analysis showed immune-dominant peptides in the most favored regions with promising interactions with HLA alleles DP, DQ, DR, and toll-like receptor showing high binding capacity. Conclusion In the present investigation, epitope 1 (LILFLIGNY) was found to be a promising candidate for the synthesis of vaccines. However, it requires further experimentation for its immunological memory and response.

摘要

引言,被世界卫生组织(WHO)指定为优先病原体,在免疫功能低下的患者中引发顽固性感染。VI型分泌系统(T6SS)是一类大分子分泌机器,对其毒力有贡献。因此,本研究的目的是预测鲍曼不动杆菌T6SS相关蛋白(AsaA)的免疫显性表位肽。方法利用计算平台从细菌中检索AsaA蛋白,并进行抗原性和致敏性评估。鉴定主要组织相容性复合体II类结合物的T细胞表位,然后使用ClusterPro服务器(https://cluspro.org/help.php)将免疫显性表位与人白细胞抗原等位基因进行分子对接。此外,还预测了B细胞表位。结果免疫信息学分析显示,在最有利区域存在免疫显性肽,与HLA等位基因DP、DQ、DR以及Toll样受体有良好的相互作用,显示出高结合能力。结论在本研究中,表位1(LILFLIGNY)被发现是合成疫苗的一个有前景的候选者。然而,其免疫记忆和反应还需要进一步实验验证。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/3a91/11146464/564c9ec8aae8/cureus-0016-00000059618-i03.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/3a91/11146464/b9e4c8b56593/cureus-0016-00000059618-i01.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/3a91/11146464/95d230eb909b/cureus-0016-00000059618-i02.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/3a91/11146464/564c9ec8aae8/cureus-0016-00000059618-i03.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/3a91/11146464/b9e4c8b56593/cureus-0016-00000059618-i01.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/3a91/11146464/95d230eb909b/cureus-0016-00000059618-i02.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/3a91/11146464/564c9ec8aae8/cureus-0016-00000059618-i03.jpg

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