Re: [ccp4bb] About generation of restraint file

Dear Tim, Thank you for your suggestion, it worked well for me! Best regards, Christian Il giorno mar 18 mar 2025 alle ore 11:56 Tim Gruene ha scritto: > On Tue, 18 Mar 2025 09:21:44 +0100 > Christian Buratto wrote: > > > Dear CCP4 community, > > I am currently tr

[ccp4bb] About generation of restraint file

Dear CCP4 community, I am currently trying to determine the structure of a protein-polyoxometalate complex. I am using a polyoxometalate molecule that is a derivative of the one deposited in the CCDC (ICSD: 173439). I am facing difficulties in generating a restraint file for this metal-oxo molecule