Protein–Protein Docking with HADDOCK

C. Schmitz, A.S.J. Melquiond, S.J. de Vries, E. Karaca, M. van Dijk, P. Kastritis, A.M.J.J. Bonvin

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Abstract

Advances in biophysics and biochemistry have pushed back the limits of the structural characterization of biomolecular assemblies. Mixing even a limited amount of experimental and/or bioinformatics data with modeling methods such as macromolecular docking represents a valuable strategy to predict the three-dimensional structures of complexes. In this chapter, we discuss the HADDOCK data-driven approach to the modeling of complexes. The program supports a wide range of NMR and other experimental data as well as bioinformatics predictions. It is also available as a user-friendly web server, facilitating the modeling of biomolecular complexes for a wide community.
Original languageEnglish
Title of host publicationNMR of biomolecules : towards mechanistic systems biology
EditorsIvano Bertini, Kathleen S. McGreevy, Giacomo Parigi
Place of PublicationWeinheim
PublisherWiley
Pages520-535
Number of pages612
ISBN (Electronic)9783527644506
ISBN (Print)9783527328505
DOIs
Publication statusPublished - 14 Mar 2012

Keywords

  • protein–protein docking
  • HADDOCK
  • bioinformatics
  • macromolecular docking
  • three-dimensional structure
  • web server
  • biomolecular modeling

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