New prediction categories in CASP15

Author:

Kryshtafovych Andriy1ORCID,Antczak Maciej23,Szachniuk Marta23ORCID,Zok Tomasz23,Kretsch Rachael C.4ORCID,Rangan Ramya4,Pham Phillip5,Das Rhiju56ORCID,Robin Xavier78ORCID,Studer Gabriel78ORCID,Durairaj Janani78,Eberhardt Jerome78,Sweeney Aaron9,Topf Maya910,Schwede Torsten78ORCID,Fidelis Krzysztof1ORCID,Moult John11

Affiliation:

1. Genome Center University of California Davis California USA

2. Institute of Computing Science, Poznan University of Technology Poznan Poland

3. Institute of Bioorganic Chemistry, Polish Academy of Sciences Poznan Poland

4. Biophysics Program, Stanford University School of Medicine Stanford California USA

5. Biochemistry Department Stanford University School of Medicine Stanford California USA

6. Howard Hughes Medical Institute, Stanford University Stanford California USA

7. Biozentrum, University of Basel Basel Switzerland

8. SIB Swiss Institute of Bioinformatics Basel Switzerland

9. Centre for Structural Systems Biology (CSSB), Leibniz‐Institut für Virologie (LIV) Hamburg Germany

10. Universitätsklinikum Hamburg Eppendorf (UKE) Hamburg Germany

11. Institute for Bioscience and Biotechnology Research, Department of Cell Biology and Molecular genetics, University of Maryland Rockville Maryland USA

Abstract

AbstractPrediction categories in the Critical Assessment of Structure Prediction (CASP) experiments change with the need to address specific problems in structure modeling. In CASP15, four new prediction categories were introduced: RNA structure, ligand‐protein complexes, accuracy of oligomeric structures and their interfaces, and ensembles of alternative conformations. This paper lists technical specifications for these categories and describes their integration in the CASP data management system.

Funder

Howard Hughes Medical Institute

National Institutes of Health

Wellcome Trust

Publisher

Wiley

Subject

Molecular Biology,Biochemistry,Structural Biology

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1. Critical assessment of methods of protein structure prediction (CASP)—Round XV;Proteins: Structure, Function, and Bioinformatics;2023-11-02

2. Automated benchmarking of combined protein structure and ligand conformation prediction;Proteins: Structure, Function, and Bioinformatics;2023-10-26

3. Assessment of three‐dimensional RNA structure prediction in CASP15;Proteins: Structure, Function, and Bioinformatics;2023-10-24

4. Breaking the conformational ensemble barrier: Ensemble structure modeling challenges in CASP15;Proteins: Structure, Function, and Bioinformatics;2023-10-23

5. The impact of AI‐based modeling on the accuracy of protein assembly prediction: Insights from CASP15;Proteins: Structure, Function, and Bioinformatics;2023-10-20

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