[chimera-dev] need your help
Eric Pettersen
pett at cgl.ucsf.edu
Tue Jan 21 11:00:25 PST 2003
Hi Johannes,
The "write relative" command provides this functionality, but I guess
we didn't anticipate writing out structures relative to non-molecule
models, so the command doesn't work when the "relative model" is a
volume (we will fix this for the next release). There is a workaround.
After you have positioned your structure as desired with respect to
your volume, open any structure whatsoever into the same model number
as your volume, then use "write relative". So, if your volume was in
model 0 and the structure you want to write is in model 1, you would:
position the models the way you want
open 0 any.pdb
write relative 0 1 transformed.pdb
If you wanted to continue working and get rid of the extra structure
you had to open, use the Model panel to close it ("close 0" in the
emulator would close the volume also).
Eric Pettersen
UCSF Computer Graphics Lab
pett at cgl.ucsf.edu
http://www.cgl.ucsf.edu
On Tuesday, January 21, 2003, at 07:25 AM, Johannes Fuerst wrote:
> Hi there,
>
> we are manually fitting crystal structures of proteins into cryo-EM
> maps with Chimera. Is there a way to read out the coordinates of the
> fitted crystal structure into a new pdb file, which could then be used
> for further refinement in other programs (ESSENS or Xplor)
>
> Thanx for your help
>
> Johannnes Furst
> Department of Biochemistry
> Brandeis University
> 415 South St
> Waltham, MA 02453
>
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