Re: [ccp4bb] Converting map to mtz file

2009-11-12 Thread Paul Emsley
Eleanor Dodson wrote: This is difficult.. Do you want to keep the same spacegroup and cell, or just embed that map in a large P1 cell and use it for molecular replacement searches? Eleanor Anita paula Testa salmazo wrote: Dear All, I have masked a map in coot and exported it. Now I'm try

Re: [ccp4bb] Converting map to mtz file

2009-10-26 Thread Eleanor Dodson
This is difficult.. Do you want to keep the same spacegroup and cell, or just embed that map in a large P1 cell and use it for molecular replacement searches? Eleanor Anita paula Testa salmazo wrote: Dear All, I have masked a map in coot and exported it. Now I'm trying to use SFall to conver

Re: [ccp4bb] Converting map to mtz file

2009-10-23 Thread Pete Meyer
Inverting a map with sfall has different restrictions on allowable gridpoints and axis order within the electron density map (due to FFT vs slow FT). Check what the sfall documentation lists as requirements for your spacegroup, and adjust the coot map output settings as needed (or if it's eas

[ccp4bb] Converting map to mtz file

2009-10-23 Thread Anita paula Testa salmazo
Dear All, I have masked a map in coot and exported it. Now I'm trying to use SFall to convert the map file to mtz file but I get the error msg: "FATAL DISAGREEMENT BETWEEN INPUT INFO AND MAP HEADER". How to solve this? Any suggestion? Thanks in advance. Regards, Anita