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CCP4 Roadmaps |
COORDINATE UTILITIES |
COORDINATE FILE MANIPULATIONS
CCP4 programs used in Coordinate file manipulation
Auxiliary CCP4 programs used in these tasks
- BONES2PDB
- Make a PDB pseudo-coordinate file from a bones file
- GENSYM
- Generate sites by symmetry
- GEOMCALC
- Molecular geometry calculations
- HGEN
- Generate hydrogen atom positions for proteins
- MAKEDICT
- Converts PDB file to TNT or PROTIN dictionaries and PROTIN to PDB
- RWCONTENTS
- Count atoms by type
- SORTWATER
- Sort waters by the protein chain to which they "belong"
- STEREO
- Extract coordinates from stereo diagrams
- WATERTIDY
- Rationalise waters at the end of refinement
- WATPEAK
- Select peaks from peakmax and put them close to the appropriate protein atoms
Further reading
CCP4 Program Documentation

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