Dear all,
I am trying to deposit 2 structures to the PDBe, solved and refined in
CCP4 (version 7), and checked in PRIVATEER as they have a lot of sugars
in. To this end, I used "Prepare and validate files for deposition"
task, as I had previously (and succesfully) done. However, and in spite
of switching to the latest CCP4 version (8.0.017), I keep getting this
error message "adding_stats_to_mmcif_i2_gui:Error in wrapper Failed to
add 204". I am using macOS Monterey, version 12.6.5.
Does anybody have an idea what is going wrong? If not, does anybody know
a different way to submit the reflection data to the PDBe? For example,
would this be somehow possible just using the output from Refmac and
AIMLESS? I wouldn't want to repeat the scaling/MR/refinement procedure
because there are a lot of sugars there, quite difficult to built.
Many thanks in advance for your help!
Kind regards,
Maria
--
Maria Dimarogona
Assistant Professor
Department of Chemical Engineering
University of Patras
Greece
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