Computational models in the service of X-ray and cryo-EM structure determination
Running title: Models in service
Andriy Kryshtafovych , 1 - Genome Center, University of California, Davis, California 95616, USA
John Moult, 2 - Institute for Bioscience and Biotechnology Research, Department of Cell Biology and Molecular genetics, University of Maryland, 9600 Gudelsky Drive, Rockville, MD 20850, USA
Reinhard Albrecht, 3 - Department of Protein Evolution, Max Planck Institute for Developmental Biology, 72076 Tübingen, Germany
Geoffrey A. Chang , 4 - Department of Pharmacology, University of California-San Diego, La Jolla, CA, 92093, USA
Kinlin Chao 5, Institute for Bioscience and Biotechnology Research, University of Maryland, Rockville, MD 20850, USA
Alec Fraser , 6 - Department of Biochemistry and Molecular Biology, Sealy Center for Structural Biology and Molecular Biophysics (SCSB), The University of Texas Medical Branch at Galveston, TX 77555, USA
Julia Greenfield 5, Institute for Bioscience and Biotechnology Research, University of Maryland, Rockville, MD 20850, USA
Marcus D. Hartmann , 3 - Department of Protein Evolution, Max Planck Institute for Developmental Biology, 72076 Tübingen, Germany
Osnat Herzberg , 5, 75Institute for Bioscience and Biotechnology Research, University of Maryland, Rockville, MD 20850, USA; 7 Department of Chemistry and Biochemistry, University of Maryland, College Park, MD 20742, USA
Inokentijs Josts, 8 - The Hamburg Advanced Research Center for Bioorganic Chemistry (HARBOR) & Department of Chemistry, Institute for Biochemistry and Molecular Biology, University of Hamburg, Luruper Chaussee 149, 22761 Hamburg, Germany
Petr G. Leiman , 6 - Department of Biochemistry and Molecular Biology, Sealy Center for Structural Biology and Molecular Biophysics (SCSB), The University of Texas Medical Branch at Galveston, TX 77555, USA
Sara B. Linden 5 - Institute for Bioscience and Biotechnology Research, University of Maryland, Rockville, MD 20850, USA
Andrei N. Lupas , 3 - Department of Protein Evolution, Max Planck Institute for Developmental Biology, 72076 Tübingen, Germany
Daniel C. Nelson 5, 9 -5 Institute for Bioscience and Biotechnology Research, University of Maryland, Rockville, MD 20850, USA; 9Department of Veterinary Medicine, University of Maryland, College Park, MD 20742, USA
Steven D. Rees , 4 - Department of Pharmacology, University of California-San Diego, La Jolla, CA, 92093, USA
Xiaoran Shang 5 - Institute for Bioscience and Biotechnology Research, University of Maryland, Rockville, MD 20850, USA
Maria L. Sokolova, 10 - Center of Life Sciences, Skolkovo Institute of Science and Technology, Moscow, 121205, Russia
Henning Tidow, 8 - The Hamburg Advanced Research Center for Bioorganic Chemistry (HARBOR) & Department of Chemistry, Institute for Biochemistry and Molecular Biology, University of Hamburg, Luruper Chaussee 149, 22761 Hamburg, Germany
and
AlphaFold2 team , 11 - DeepMind, London, EC4A 3TW, UK
Keywords: X-ray crystallography; cryo-EM; CASP, Protein Structure Prediction.
Abbreviations: CASP: community wide experiment on the Critical Assessment of Techniques for Protein Structure Prediction; MR:molecular replacement; cryo-EM: cryo-electron microscopy;NMR: nuclear magnetic resonance