Heidarinia Hana, Ghadiri Keyghobad, Zargaran Fatemeh Nemati, Lorestani Roya Chegene, Rostamian Mosayeb
Department of Microbiology, Shahrekord Branch, Islamic Azad University, Shahrekord, Iran.
Infectious Diseases Research Center, Health Institute, Kermanshah University of Medical Sciences, Kermanshah, Iran.
Curr Comput Aided Drug Des. 2024 Jan 29. doi: 10.2174/0115734099281401240118054834.
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.
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.
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.
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.
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.
鲍曼不动杆菌是医院感染的主要原因之一。目前尚无已获许可用于人类的疫苗,相关研究仍在进行中。
在本研究中,我们通过使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,作为未来研究中可能的疫苗候选物。
使用七种不同的预测工具预测线性B细胞表位。对OMPK的三维结构进行建模,并通过ElliPro和DiscoTope 2.0工具用于预测不连续表位。检查最终的线性表位和不连续表位片段的潜在致敏性、毒性、与人类的相似性以及实验记录。通过多种生物信息学工具评估最终表位肽的结构和理化特性。
检测到许多可评估其潜在抗原性和免疫原性的B细胞表位。此外还发现了OMPK的一个包含线性和不连续B细胞表位的22肽表位区域。已发现该表位肽具有合适的理化和结构特性,可作为鲍曼不动杆菌疫苗候选物。
总之,本研究确定了OMPK具有高免疫原性的B细胞表位,并引入了一种具有高免疫原性的22肽作为鲍曼不动杆菌疫苗候选物。建议对该肽进行体外/体内研究,以确定其实际疗效和效果。