[ccp4bb]: origin in tls

[Santiago Ramon <sramon@ibv.csic.es>]

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Dear ccp4 users:

I am refining a P1 crystal with refmac5, and I am having problems to do TLS 
using the TLSOUT file from the previous TLS refinement. I do not have 
problems to carry out a first tls refinement, and it seems to work 
properly, but if I use the TLSOUT file to carry out a second tls the 
computer gets stuck. This does not happen if I erase previously the origin 
lines from the TLSOUT file (I also modify the range values which seem to 
change after every refinement, I get something like RANGE  'A   2.' 'A 310. 
'MNC    instead of   RANGE  'A   2' 'A 310' MNC).
I would appreciate any suggestion or explanation about why refmac5 has 
problems with the origin in P1, or if any other thing could be wrong and I 
had not notice.

Many thanks in advance,

Santiago





Santiago Ramón-Maiques
Instituto de Biomedicina de Valencia
Consejo Superior de Investigaciones Científicas
C/ Jaime Roig, 11
46010 Valencia, Spain