An In silico Study on B-cell Epitope Mapping of Acinetobacter baumannii Outer Membrane Protein K.

Hana Heidarinia, Keyghobad Ghadiri, Fatemeh Nemati Zargaran, Roya Chegene Lorestani, Mosayeb Rostamian
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Abstract

Background: Acinetobacter baumannii is one of the main causes of nosocomial infections. No vaccine has yet been licensed for use in humans, and efforts are still ongoing.

Objective: In the present study, we have predicted the B-cell epitopes of A. baumannii's outer membrane protein K (OMPK) by using epitope prediction algorithms as possible vaccine candidates for future studies.

Methods: The linear B-cell epitopes were predicted by seven different prediction tools. The 3D structure of OMPK was modeled and used for discontinuous epitope prediction by ElliPro and DiscoTope 2.0 tools. The final linear epitopes and the discontinuous epitope segments were checked for potential allergenicity, toxicity, human similarity, and experimental records. The structure and physicochemical features of the final epitopic peptide were assessed by numerous bioinformatics tools.

Results: Many B-cell epitopes were detected that could be assessed for possible antigenicity and immunogenicity. Also, an epitopic 22-mer region (peptide) of OMPK was found that contained both linear and discontinuous B-cell epitopes. This epitopic peptide has been found to possess appropriate physicochemical and structural properties to be an A. baumannii vaccine candidate.

Conclusion: Altogether, here, the high immunogenic B-cell epitopes of OMPK have been identified, and a high immunogenic 22-mer peptide as an A. baumannii vaccine candidate has been introduced. The in vitro/in vivo studies of this peptide are recommended to decide its real efficacy and efficiency.

关于鲍曼不动杆菌外膜蛋白 K 的 B 细胞表位图的硅学研究
背景:鲍曼不动杆菌是造成医院内感染的主要原因之一。目前还没有疫苗被许可用于人类,相关工作仍在进行中:在本研究中,我们利用表位预测算法预测了鲍曼不动杆菌外膜蛋白 K(OMPK)的 B 细胞表位,作为未来研究的候选疫苗:方法:使用七种不同的预测工具预测线性 B 细胞表位。用 ElliPro 和 DiscoTope 2.0 工具对 OMPK 的三维结构进行建模并用于非连续表位预测。对最终的线性表位和非连续表位片段进行了潜在过敏性、毒性、人体相似性和实验记录检查。最终表位肽的结构和理化特征由多种生物信息学工具进行评估:结果:检测到许多 B 细胞表位,可评估其可能的抗原性和免疫原性。此外,还发现 OMPK 的一个 22 个聚合物的表位区域(肽)同时包含线性和不连续的 B 细胞表位。该表位肽具有适当的理化和结构特性,可作为鲍曼不动杆菌疫苗候选物:总之,本文确定了 OMPK 的高免疫原性 B 细胞表位,并提出了一种高免疫原性 22 聚体肽作为鲍曼不动杆菌疫苗候选物。建议对该多肽进行体外/体内研究,以确定其实际功效和效率。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
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