dbAMP 3.0: updated resource of antimicrobial activity and structural annotation of peptides in the post-pandemic era

IF 16.6 2区 生物学 Q1 BIOCHEMISTRY & MOLECULAR BIOLOGY
Lantian Yao, Jiahui Guan, Peilin Xie, Chia-Ru Chung, Zhihao Zhao, Danhong Dong, Yilin Guo, Wenyang Zhang, Junyang Deng, Yuxuan Pang, Yulan Liu, Yunlu Peng, Jorng-Tzong Horng, Ying-Chih Chiang, Tzong-Yi Lee
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引用次数: 0

Abstract

Antimicrobial resistance is one of the most urgent global health threats, especially in the post-pandemic era. Antimicrobial peptides (AMPs) offer a promising alternative to traditional antibiotics, driving growing interest in recent years. dbAMP is a comprehensive database offering extensive annotations on AMPs, including sequence information, functional activity data, physicochemical properties and structural annotations. In this update, dbAMP has curated data from over 5200 publications, encompassing 33,065 AMPs and 2453 antimicrobial proteins from 3534 organisms. Additionally, dbAMP utilizes ESMFold to determine the three-dimensional structures of AMPs, providing over 30,000 structural annotations that facilitate structure-based functional insights for clinical drug development. Furthermore, dbAMP employs molecular docking techniques, providing over 100 docked complexes that contribute useful insights into the potential mechanisms of AMPs. The toxicity and stability of AMPs are critical factors in assessing their potential as clinical drugs. The updated dbAMP introduced an efficient tool for evaluating the hemolytic toxicity and half-life of AMPs, alongside an AMP optimization platform for designing AMPs with high antimicrobial activity, reduced toxicity and increased stability. The updated dbAMP is freely accessible at https://awi.cuhk.edu.cn/dbAMP/. Overall, dbAMP represents a comprehensive and essential resource for AMP analysis and design, poised to advance antimicrobial strategies in the post-pandemic era.
dbAMP 3.0:后流行病时代多肽抗菌活性和结构注释的最新资源
抗菌素耐药性是最紧迫的全球健康威胁之一,尤其是在大流行后的时代。dbAMP 是一个综合性数据库,提供有关抗菌肽的大量注释,包括序列信息、功能活性数据、理化性质和结构注释。在本次更新中,dbAMP 已从 5200 多篇论文中整理出数据,涵盖来自 3534 种生物的 33,065 种 AMP 和 2453 种抗菌蛋白。此外,dbAMP 利用 ESMFold 确定了 AMP 的三维结构,提供了 30,000 多条结构注释,为临床药物开发提供了基于结构的功能见解。此外,dbAMP 还采用了分子对接技术,提供了 100 多个对接复合物,有助于深入了解 AMPs 的潜在机制。AMPs 的毒性和稳定性是评估其作为临床药物潜力的关键因素。更新后的 dbAMP 提供了一个评估 AMP 溶血毒性和半衰期的有效工具,以及一个 AMP 优化平台,用于设计具有高抗菌活性、低毒性和高稳定性的 AMP。更新后的 dbAMP 可在 https://awi.cuhk.edu.cn/dbAMP/ 免费访问。总之,dbAMP 是分析和设计 AMP 的全面而重要的资源,有望在后流行病时代推动抗菌策略的发展。
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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来源期刊
Nucleic Acids Research
Nucleic Acids Research 生物-生化与分子生物学
CiteScore
27.10
自引率
4.70%
发文量
1057
审稿时长
2 months
期刊介绍: Nucleic Acids Research (NAR) is a scientific journal that publishes research on various aspects of nucleic acids and proteins involved in nucleic acid metabolism and interactions. It covers areas such as chemistry and synthetic biology, computational biology, gene regulation, chromatin and epigenetics, genome integrity, repair and replication, genomics, molecular biology, nucleic acid enzymes, RNA, and structural biology. The journal also includes a Survey and Summary section for brief reviews. Additionally, each year, the first issue is dedicated to biological databases, and an issue in July focuses on web-based software resources for the biological community. Nucleic Acids Research is indexed by several services including Abstracts on Hygiene and Communicable Diseases, Animal Breeding Abstracts, Agricultural Engineering Abstracts, Agbiotech News and Information, BIOSIS Previews, CAB Abstracts, and EMBASE.
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