PDBe: improved findability of macromolecular structure data in the PDB

Author:

Armstrong David R1ORCID,Berrisford John M1,Conroy Matthew J1,Gutmanas Aleksandras1ORCID,Anyango Stephen1,Choudhary Preeti1,Clark Alice R1,Dana Jose M1,Deshpande Mandar1ORCID,Dunlop Roisin1,Gane Paul1,Gáborová Romana2,Gupta Deepti1,Haslam Pauline1,Koča Jaroslav2,Mak Lora1,Mir Saqib1ORCID,Mukhopadhyay Abhik1,Nadzirin Nurul1,Nair Sreenath1,Paysan-Lafosse Typhaine13,Pravda Lukas1,Sehnal David2,Salih Osman4,Smart Oliver1,Tolchard James1,Varadi Mihaly1ORCID,Svobodova-Vařeková Radka2,Zaki Hossam1,Kleywegt Gerard J14,Velankar Sameer1

Affiliation:

1. Protein Data Bank in Europe, European Molecular Biology Laboratory, European Bioinformatics Institute (EMBL-EBI), Wellcome Genome Campus, Hinxton, Cambridge CB10 1SD, UK

2. CEITEC - Central European Institute of Technology, Masaryk University Brno, Kamenice 5, 625 00 Brno-Bohunice, Czech Republic

3. InterPro, European Molecular Biology Laboratory, European Bioinformatics Institute (EMBL-EBI), Wellcome Genome Campus, Hinxton, Cambridge CB10 1SD, UK

4. Electron Microscopy Data Bank (EMDB), European Molecular Biology Laboratory, European Bioinformatics Institute (EMBL-EBI), Wellcome Genome Campus, Hinxton, Cambridge CB10 1SD, UK

Abstract

AbstractThe Protein Data Bank in Europe (PDBe), a founding member of the Worldwide Protein Data Bank (wwPDB), actively participates in the deposition, curation, validation, archiving and dissemination of macromolecular structure data. PDBe supports diverse research communities in their use of macromolecular structures by enriching the PDB data and by providing advanced tools and services for effective data access, visualization and analysis. This paper details the enrichment of data at PDBe, including mapping of RNA structures to Rfam, and identification of molecules that act as cofactors. PDBe has developed an advanced search facility with ∼100 data categories and sequence searches. New features have been included in the LiteMol viewer at PDBe, with updated visualization of carbohydrates and nucleic acids. Small molecules are now mapped more extensively to external databases and their visual representation has been enhanced. These advances help users to more easily find and interpret macromolecular structure data in order to solve scientific problems.

Funder

European Molecular Biology Laboratory

European Bioinformatics Institute

Wellcome Trust

Biotechnology and Biological Sciences Research Council

European Union

Publisher

Oxford University Press (OUP)

Subject

Genetics

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