Dear all,

I am trying to run EDSTATS on a neutron structure containing a manganese ion 
(https://www.rcsb.org/structure/7KKW), but either I am doing something wrong or 
something is broken. When using EDSTATS supplied with CCP4 8.0 I end up with 
the error message:

mtzfix:  WARNING: Output file is corrupt so deleted.

ERROR in mtzfix: stopping.


Using EDSTATS supplied with CCP4 7.0, the error message instead becomes:

ERROR in radius calculation: max iterations.

ERROR in RADINT:   2


Oddly enough, when changing MN to FE in the model, EDSTATS in CCP4 7.0 works 
fine. EDSTATS in CCP4 8.0 with FE however again gives me the error message:

mtzfix:  WARNING: Output file is corrupt so deleted.

ERROR in mtzfix: stopping.


Any help or advice would be greatly appreciated!

Kind regards
Kristoffer Lundgren

########################################################################

To unsubscribe from the CCP4BB list, click the following link:
https://www.jiscmail.ac.uk/cgi-bin/WA-JISC.exe?SUBED1=CCP4BB&A=1

This message was issued to members of www.jiscmail.ac.uk/CCP4BB, a mailing list 
hosted by www.jiscmail.ac.uk, terms & conditions are available at 
https://www.jiscmail.ac.uk/policyandsecurity/

Reply via email to