Department of Chemical Biology, Faculty of Biotechnology, University of Wrocław, F. Joliot-Curie 14a, 50-383 Wrocław, Poland.
J Proteome Res. 2021 Apr 2;20(4):1889-1901. doi: 10.1021/acs.jproteome.0c00906. Epub 2021 Jan 27.
InterMetalDB is a free-of-charge database and browser of intermolecular metal binding sites that are present on the interfaces of macromolecules forming larger assemblies based on structural information deposited in Protein Data Bank (PDB). It can be found and freely used at https://intermetaldb.biotech.uni.wroc.pl/. InterMetalDB collects the interfacial binding sites with involvement of metal ions and clusters them on the basis of 50% sequence similarity and the nearest metal environment (5 Å radius). The data are available through the web interface where they can be queried, viewed, and downloaded. Complexity of the query depends on the user, because the questions in the query are connected with each other by a logical AND. InterMetalDB offers several useful options for filtering records including searching for structures by particular parameters such as structure resolution, structure description, and date of deposition. Records can be filtered by coordinated metal ion, number of bound amino acid residues, coordination sphere, and other features. InterMetalDB is regularly updated and will continue to be regularly updated with new content in the future. InterMetalDB is a useful tool for all researchers interested in metalloproteins, protein engineering, and metal-driven oligomerization.
InterMetalDB 是一个免费的数据库和浏览器,用于研究存在于大分子界面上的分子间金属结合位点,这些大分子是基于蛋白质数据库 (PDB) 中储存的结构信息形成更大的组装体。它可以在 https://intermetaldb.biotech.uni.wroc.pl/ 上找到并免费使用。InterMetalDB 收集了涉及金属离子的界面结合位点,并根据 50%的序列相似性和最近的金属环境(5 Å 半径)对其进行聚类。这些数据可通过网络界面查询、查看和下载。查询的复杂性取决于用户,因为查询中的问题通过逻辑“与”相互连接。InterMetalDB 提供了几种有用的记录筛选选项,包括按特定参数(如结构分辨率、结构描述和沉积日期)搜索结构。记录还可以按配位金属离子、结合的氨基酸残基数、配位球和其他特征进行筛选。InterMetalDB 定期更新,未来将继续定期更新新内容。InterMetalDB 是所有对金属蛋白、蛋白质工程和金属驱动的寡聚化感兴趣的研究人员的有用工具。