[Chimera-users] Error when making Covalent bonds
Elaine Meng
meng at cgl.ucsf.edu
Tue Oct 25 09:23:14 PDT 2005
Hi David,
Currently you cannot form a bond between two different models, i.e.
structures opened from two different files (or separated with MODEL/
ENDMDL records in a single file). You need to first put the
coordinates for both structures in the same PDB file, without MODEL/
ENDMDL records. There may be an issue of duplicate residue numbers;
if so, you'd need to renumber to avoid the problem. For example,
if one structure has residues 1-10 and another has residues 1-50, the
coordinates should be concatenated into one file and renumbered so
that no two residues have the same number (1-60 is
one possibility; 1-10, 100-150 is another).
Hope this helps,
Elaine
-----
Elaine C. Meng, Ph.D. meng at cgl.ucsf.edu
UCSF Computer Graphics Lab and Babbitt Lab
Department of Pharmaceutical Chemistry
University of California, San Francisco
http://www.cgl.ucsf.edu/home/meng/index.html
On Oct 25, 2005, at 12:31 AM, David Chenoweth wrote:
> Hi!
>
> I am trying to pull up two molecules in chimera and link them by
> forming a covalent bond between a N and C atom. I am selecting only
> the N of one molecule and the C of the other. When I go to command
> line and use the bond sel command I get the following error message.
>
> Type error: Cannot form covalent bond joining two molecules.
>
> Does anyone know how to get around this.
>
> Thanks,
> David C.
>
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