Re: [ccp4bb] adding external planar restraint in refmac5

2020-07-08 Thread Paul Emsley
On 08/07/2020 12:39, Laurent wrote: I am currently refinining an enzyme structure obtained in the presence of a substrate analog : the catalytic serine is acylated and form an ester bond with the ligand. I have added a LINK record in the PDB file to specify the newly created covalent bond b

[ccp4bb] adding external planar restraint in refmac5

2020-07-08 Thread Laurent
Dear CCP4 users, I am currently refinining an enzyme structure obtained in the presence of a substrate analog : the catalytic serine is acylated and form an ester bond with the ligand. I have added a LINK record in the PDB file to specify the newly created covalent bond between OG atom of Serin