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Pex, analytical tools for PDB files. I. GF-Pex: Basic file to describe a protein

✍ Scribed by Annick Thomas; Olivier Bouffioux; Dominique Geeurickx; Robert Brasseur


Book ID
101324733
Publisher
John Wiley and Sons
Year
2001
Tongue
English
Weight
297 KB
Volume
43
Category
Article
ISSN
0887-3585

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✦ Synopsis


Pex are created to extract numeric and string descriptions of protein structures from PDB files. This concerns covalent bond lengths and angles, secondary structures, residues in interaction, H-bond lengths and geometry, etc. Several kinds of Pex are generated: (1) general feature (GF-Pex); (2) H-bond (H-Pex); and (3) accessible surface (AS-Pex) and force potential (FP-Pex). We describe the general principles of Pex and detail the GF-Pex files. Using the GF-Pex of 131 proteins, we analyze the mean residue frequencies, the straight phi/psi distribution and the major kinds of secondary structures in proteins. Thomas et al. (this issue) analyzes the main chain H-bonds in those proteins. The GF-Pex and H-Pex files of the 131 proteins can be downloaded from the CBMN site (http://www.fsagx.ac.be/bp/). Proteins 2001;43:28-36.