[phenixbb] creating cif for Zn

Nathaniel Echols NEchols at lbl.gov
Tue May 26 12:44:02 PDT 2009

On May 26, 2009, at 12:31 PM, Raja Dey wrote:
> Dear Friends,
>                     I have Zn atoms in my pdb file. So, I think I  
> need to run elbow to create the cif  otherwise refinement stops.

Like Pavel said, this isn't necessary - however, if you want to define  
metal coordination geometry restraints, you can just use the commands  
phenix.metal_coordination or phenix.ready_set (which combines many  
functions for preparing PDB files).


Nathaniel Echols
Lawrence Berkeley Lab
NEchols at lbl.gov

More information about the phenixbb mailing list