Re: [ccp4bb] Morphing with mutations

2007-10-03 Thread Mario A. Bianchet
Gerard What about to do a cartesian morphing with the mutated residue added (or removed) atoms having initial ( or final) coordinates taken from previous common atom? Will work? Coloring may be a factor... but with a manual editing perhaps... Mario Gerard DVD Kleywegt

Re: [ccp4bb] Morphing with mutations

2007-10-03 Thread Gerard DVD Kleywegt
What about to do a cartesian morphing with the mutated residue added (or removed) atoms having initial ( or final) coordinates taken from previous common atom? Will work? Coloring may be a factor... but with a manual editing perhaps... you mean, for instance, if you

[ccp4bb] assigning water molecules to monomers

2007-10-03 Thread Vineet Gaur
Hi All i am solving a structure with four molecules in asymmetric unit. Initially i was refining the structure with four fold NCS, which now i have removed. i have picked some of the water molecules after removing the NCS. now i m facing the problem of assigning these water molecules to

Re: [ccp4bb] assigning water molecules to monomers

2007-10-03 Thread Phil Evans
sortwater (CCP4) will do this On 3 Oct 2007, at 15:57, Vineet Gaur wrote: Hi All i am solving a structure with four molecules in asymmetric unit. Initially i was refining the structure with four fold NCS, which now i have removed. i have picked some of the water molecules after

[ccp4bb] Beam Time Available @X6A

2007-10-03 Thread Stojanoff, Vivian
The NIGMS East Coast Structural Biology Facility has beam time for fast access starting October 13. Available time can be checked through the link bellow http://protein.nsls.bnl.gov Do you have a project or if you want to submit a new project you will be able to schedule your own beam time

[ccp4bb] Twinning: P43 apparently P42212

2007-10-03 Thread Charlie Bond
Hi All, I'm trying to understand what's going on in one of our crystals: Merging and sysabs clearly indicate P42212. Looking at the intensities, 00l=2n are absolutely clearly present and are not systematically weaker than 004n. Intensity stats show clear signs of twinning. The structure can