Jan

I'd still interested in seeing the "wrong" geometry.

Cheers

Nigel

On Wed, Dec 12, 2012 at 9:55 AM, Jan van Agthoven <janccp4@gmail.com> wrote:
Sorry Nigel! I think I got a little confused here. The question was about the configuration of the ASN-NAG link. But by modifying it with Coot it remains correct after refinement. So problem solved. Sorry for the inconvenience.

Sent from my iPodu

On Dec 10, 2012, at 2:38 PM, Nigel Moriarty <nwmoriarty@lbl.gov> wrote:

Jan

NAG is the beta form. NDG is the alpha form. You may have an incorrect geometry.

Are you asking how to link two carbohydrate units?

If you can send me the model.pdb I will take a look.

Cheers

Nigel

NB. Any files sent to me will be held in strictest confidence.


On Mon, Dec 10, 2012 at 7:41 AM, Jan van Agthoven <janccp4@gmail.com> wrote:
Hi everyone,
I refined my structure using phenix.refine and used the following
parameters to define the ASN-NAG link:
refinement.pdb_interpretation.apply_cif_link {
  data_link = NAG-ASN
  residue_selection_1 = chain A and resname NAG and resseq  x
  residue_selection_2 = chain A and resname ASN and resseq   y
}

However I would like the glycosylation to be Beta (NAG in Beta configuration).
How can I define this in the parameter file?
Thanks,
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Nigel W. Moriarty
Building 64R0246B, Physical Biosciences Division
Lawrence Berkeley National Laboratory
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--
Nigel W. Moriarty
Building 64R0246B, Physical Biosciences Division
Lawrence Berkeley National Laboratory
Berkeley, CA 94720-8235
Phone : 510-486-5709     Email : NWMoriarty@LBL.gov
Fax   : 510-486-5909       Web  : CCI.LBL.gov