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    Nucleic Acids Res. 2010 Jul;38(Web Server issue):W569-75. doi: 10.1093/nar/gkq369. Epub 2010 May 12.

    RosettaBackrub--a web server for flexible backbone protein structure modeling and design.

    Source

    Department of Bioengineering and Therapeutic Sciences, University of California at San Francisco, 1700 4th Street, San Francisco, CA 94158, USA.

    Abstract

    The RosettaBackrub server (http://kortemmelab.ucsf.edu/backrub) implements the Backrub method, derived from observations of alternative conformations in high-resolution protein crystal structures, for flexible backbone protein modeling. Backrub modeling is applied to three related applications using the Rosetta program for structure prediction and design: (I) modeling of structures of point mutations, (II) generating protein conformational ensembles and designing sequences consistent with these conformations and (III) predicting tolerated sequences at protein-protein interfaces. The three protocols have been validated on experimental data. Starting from a user-provided single input protein structure in PDB format, the server generates near-native conformational ensembles. The predicted conformations and sequences can be used for different applications, such as to guide mutagenesis experiments, for ensemble-docking approaches or to generate sequence libraries for protein design.

    PMID:
    20462859
    [PubMed - indexed for MEDLINE]
    PMCID:
    PMC2896185
    Free PMC Article

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