On 04/11/14 20:35, Jan Stransky wrote:
[log in to unmask]" type="cite">
Hi Dorothy,
this dashed lines represent links.
Yes - you can tell this because they are drawn in the same colours
as the molecule with the half-bond colour scheme.
[log in to unmask]" type="cite">You
can delete them in PDB-file, look for keywords LINK and LINKER.
LINK and LINKR.
[log in to unmask]" type="cite"> In
coot you can create them via tool in menu.
However its creation after Real Space Refinemnet or Regularize
zone looks to me as a bug.
Not a bug, which is to say, the program is working as expected. The
RSR that you get from clicking on the toolbar button is
simple-minded in its residue selection.
For Coot to take into account the links, one should first use an
mmCIF file that defines the link and second, use Sphere Refine -
which does a better job at residue selection than does standard
"blue circle button" refine.
Paul.