Dear Almudena,
On Tue, Jan 14, 2014 at 07:34:21PM +0100, Almudena Ponce Salvatierra wrote:
> Dear all,
>
> I find this error message while running autosharp:
>
> No column "FP" of type "F" found in file
> /usr/local/sharp/users/sharp/None.sharp/datafiles/xxx.mtz!
>
> Does anybody know how to solve it? I have tried several things but they did
> not work. I am quite new with this software so any suggestions are welcome!
When giving autoSHARP the reflection data in MTZ format, you also need
to tell it the column labels for the required items: F, SIGF, DANO,
SIGDANO and (optional) ISYM. Remember that MTZ files can contain more
than a single set of amplitudes, anomalous differences etc. It looks
as if you left the defaults ("FP") while selecting your own MTZ file
that uses different column names? What does
% mtzdmp /usr/local/sharp/users/sharp/None.sharp/datafiles/xxx.mtz
give you as column names (table towards the end)?
You can make your life easier by using a SCALEPACK formatted file
(*.sca) as input to autoSHARP: since that will only contain a single
dataset you don't need to specify anything else.
Hope that helps
Clemens
PS: you might want to ask on the sharp-discuss mailing list or have a
browse the SHARP/autoSHARP wiki for tutorials etc ... more info at
www.globalphasing.com/sharp/.
--
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* Clemens Vonrhein, Ph.D. vonrhein AT GlobalPhasing DOT com
*
* Global Phasing Ltd.
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