International
Tables for
Crystallography
Volume F
Crystallography of biological macromolecules
Edited by M. G. Rossmann and E. Arnold

© International Union of Crystallography 2006
International Tables for Crystallography (2006). Vol. F. ch. 25.2, p. 705

Section 25.2.1.13.1. Coordinate conversions

W. Fureya*

25.2.1.13.1. Coordinate conversions

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Within the package, fractional atomic coordinates are used extensively, and the program [{PDB\_CDS}] is provided to convert from PDB (Protein Data Bank) to PHASES coordinate files and vice versa. The program prompts for input and output file names, the direction of the conversion, chain or residue ranges, and whether to reset occupancies and/or thermal factors to specified values. The coordinate ranges (both fractional and in PDB coordinates) spanned by the model are also listed.








































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