PDB NextGen Archive: centralizing access to integrated annotations and enriched structural information by the Worldwide Protein Data Bank.

IF 4.3 3区 材料科学 Q1 ENGINEERING, ELECTRICAL & ELECTRONIC ACS Applied Electronic Materials Pub Date : 2024-05-27 DOI:10.1093/database/baae041
Preeti Choudhary, Zukang Feng, John Berrisford, Henry Chao, Yasuyo Ikegawa, Ezra Peisach, Dennis W Piehl, James Smith, Ahsan Tanweer, Mihaly Varadi, John D Westbrook, Jasmine Y Young, Ardan Patwardhan, Kyle L Morris, Jeffrey C Hoch, Genji Kurisu, Sameer Velankar, Stephen K Burley
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Abstract

The Protein Data Bank (PDB) is the global repository for public-domain experimentally determined 3D biomolecular structural information. The archival nature of the PDB presents certain challenges pertaining to updating or adding associated annotations from trusted external biodata resources. While each Worldwide PDB (wwPDB) partner has made best efforts to provide up-to-date external annotations, accessing and integrating information from disparate wwPDB data centers can be an involved process. To address this issue, the wwPDB has established the PDB Next Generation (or NextGen) Archive, developed to centralize and streamline access to enriched structural annotations from wwPDB partners and trusted external sources. At present, the NextGen Archive provides mappings between experimentally determined 3D structures of proteins and UniProt amino acid sequences, domain annotations from Pfam, SCOP2 and CATH databases and intra-molecular connectivity information. Since launch, the PDB NextGen Archive has seen substantial user engagement with over 3.5 million data file downloads, ensuring researchers have access to accurate, up-to-date and easily accessible structural annotations. Database URL: http://www.wwpdb.org/ftp/pdb-nextgen-archive-site.

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PDB NextGen Archive:通过全球蛋白质数据库集中获取综合注释和丰富的结构信息。
蛋白质数据库(PDB)是公共领域实验确定的三维生物分子结构信息的全球存储库。PDB 的存档性质给从可信的外部生物数据资源更新或添加相关注释带来了一定的挑战。虽然全球生物数据库(wwPDB)的每个合作伙伴都尽最大努力提供最新的外部注释,但从不同的wwPDB数据中心访问和整合信息可能是一个复杂的过程。为了解决这个问题,wwPDB 建立了 PDB 下一代(或 NextGen)档案,以集中和简化对来自 wwPDB 合作伙伴和可信外部来源的丰富结构注释的访问。目前,NextGen 档案提供了实验确定的蛋白质三维结构与 UniProt 氨基酸序列之间的映射、来自 Pfam、SCOP2 和 CATH 数据库的结构域注释以及分子内连接性信息。自推出以来,PDB NextGen Archive 的用户参与度很高,数据文件下载量超过 350 万次,确保研究人员能够获得准确、最新且易于访问的结构注释。数据库网址:http://www.wwpdb.org/ftp/pdb-nextgen-archive-site.
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4.30%
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567
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