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Re: [ccp4bb]: Hi all,
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*** CCP4 home page http://www.dl.ac.uk/CCP/CCP4/main.html ***
SFALL only needs data if you have the word HKLIN on the MODE line.
Use:
MODE SFCALC XYZIN
RESOLUTION 999 2.0 !or whatever
and you will get a complete set of calculated data
in the resolution range, with only the pdb file as input.
Check the documentation:
http://www.dl.ac.uk/CCP/CCP4/dist/html/sfall.html#mode
--
Ed