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      MOLPROBITY: structure validation and all-atom contact analysis for nucleic acids and their complexes.

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          Abstract

          MolProbity is a general-purpose web service offering quality validation for three-dimensional (3D) structures of proteins, nucleic acids and complexes. It provides detailed all-atom contact analysis of any steric problems within the molecules and can calculate and display the H-bond and van der Waals contacts in the interfaces between components. An integral step in the process is the addition and full optimization of all hydrogen atoms, both polar and nonpolar. The results are reported in multiple forms: as overall numeric scores, as lists, as downloadable PDB and graphics files, and most notably as informative, manipulable 3D kinemage graphics shown on-line in the KiNG viewer. This service is available free to all users at http://kinemage.biochem.duke.edu.

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          Author and article information

          Journal
          Nucleic Acids Res
          Nucleic acids research
          Oxford University Press (OUP)
          1362-4962
          0305-1048
          Jul 01 2004
          : 32
          : Web Server issue
          Affiliations
          [1 ] Department of Biochemistry, Duke University, Durham, NC 27710-3711, USA.
          Article
          32/suppl_2/W615
          10.1093/nar/gkh398
          441536
          15215462
          c70f30ab-ecae-47d7-808b-e406c20dcb25
          History

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