Dear Kristof,
There is a button to disable the Wilson Check, under 'ARP/wARP flow
parameters'.
Having 100% solvent though, to me looks very suspicious; very likely
your file
was misread by ARP/wARP, and the job will go wrong later.
I admit I have never before added waters to DNA only and never checked
if that causes some technical trouble.
Indeed, the previous implementation with Refmac was also very handy, and
we were equally surprised to see that removed in the new CCP4.
It might be reinstated in the near future.
Tassos
On 14 Mar 2009, at 17:50, Kristof Van Hecke wrote:
Dear all,
When refining a DNA-structure (poor data, resolution 2.5) and using
ARP/wARP Solvent 7.0.1. for water divining with CCP4 6.1.1 and GUI
2.0.4, I get the following error:
QUITTING ... ARP/wARP module stopped with an error message:
ARP_WARP_MODE_WILSON
When checking the "warp_wilson_log" file, I get:
Comments: Overall fit of the data to the Wilson curve:
Comments: Problems Resolution range 5.15 to 4.89
Comments: Problems Resolution range 4.89 to 4.67
Comments: Problems Resolution range 2.89 to 2.84
Comments: Possible reasons - missing overloads
Solvent content 1.00
Computed solvent content is too high - check your input
***** ERROR *****
I was kind of surprised, because with the same data! and an older
version of ARP/wARP, which was integrated in the Refmac5 program, I
did
not get any errors of this kind..!?
Is there a way to circumvent this please..?
Many thanks
Kristof Van Hecke
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