Hi all:

I want to adjust a .cif file for a ligand that is covalently attached to a 
threonine residue and wanted to make the link between the Thr residue and 
ligand planar.

I think adding the following line would be the way to define this.


_chem_link_plane_atom.atom_id


My question is how do I correctly format the atom id (i.e. list of atoms in the 
plane) after this line with the atoms so that REMFAC can properly recognize 
them.



Thanks for your suggestions,


George




########################################################################

To unsubscribe from the CCP4BB list, click the following link:
https://www.jiscmail.ac.uk/cgi-bin/webadmin?SUBED1=CCP4BB&A=1

Reply via email to