The GUI actually is a quite convenient way. In my experience, however, the
GUI or the program called by the GUI does not check whether the cif
contains intensities or amplitudes. So you can use the GUI, look at the
script it generates and adjust it according to the header in your cif.
Tim
--
Tim Gruene
Institut fuer anorganische Chemie
Tammannstr. 4
D-37077 Goettingen
GPG Key ID = A46BEE1A
On Tue, 29 Jan 2008, Kristof Van Hecke wrote:
Dear all,
I'm looking for a convenient way of converting a .cif structure factor file
(from PDB) to a map-file (e.g. .mtz) to open with COOT for example..?
Already tried ccp4i with 'Convert to/modify/extend MTZ', but got a bunch of
errors when opening with coot..
Many thanks
Kristof
--------------------------------------
Kristof Van Hecke, PhD
Biomoleculaire Architectuur
Celestijnenlaan 200 F
B-3001 Heverlee (Leuven)
Tel: +32(0)16327477
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