Re: [ccp4bb] Watertidy troubles

2009-04-27 Thread Andrii Ishchenko
You can do this using coot. Just switch on showing symmetry mates(menu Draw->Cell&Symmetry). Then save the needed by "Save Symmetry Coordinates Option" in menu File. Waters coordinates will be saved as well. Regards, Andrii

[ccp4bb] fix atomic positions in REFMAC5

2009-01-27 Thread Andrii Ishchenko
Is there a possibility in refmac5 to fix atomic positions of some part of the molecule and to refine the other part? I couldn't find a proper keyword in keywords list:(