Dear Charis, Please see: https://www.wwpdb.org/news/news?year=2023#654a801dd78e004e766a96bd
Because wwPDB has changed these atoms names, the monomer library was updated accordingly. More than 800 monomers were affected. We have added the old atom names in _chem_comp_atom.alt_atom_id to help programs translate the names, but unfortunately the programs were not ready. If you are working with the old atom names, you can use CCP4 8.0.019, which has the previous monomer library. The next CCP4 update is expected to include the latest library along with programs (at least refmacat) that can understand both old and new atom names. Best regards, Keitaro On Wed, 22 May 2024 at 22:16, Harris Georgiou <harris.88.b...@hotmail.com> wrote: > > Dear colleagues, > > We have recently discovered a change in the monomer library and specifically > a change in the atom names of PYR.cif. The atom names of this monomer were > changed between ccp4 version 8.0.016 and version 8.0.018. We were wondering > if this change was on purpose and if these new atom names will be kept in all > new versions. Also was there a change in other monomers as well? Did any of > you discover similar changes? > > > Best regards, > > Charis Georgiou > > > ________________________________ > > To unsubscribe from the CCP4BB list, click the following link: > https://www.jiscmail.ac.uk/cgi-bin/WA-JISC.exe?SUBED1=CCP4BB&A=1 ######################################################################## To unsubscribe from the CCP4BB list, click the following link: https://www.jiscmail.ac.uk/cgi-bin/WA-JISC.exe?SUBED1=CCP4BB&A=1 This message was issued to members of www.jiscmail.ac.uk/CCP4BB, a mailing list hosted by www.jiscmail.ac.uk, terms & conditions are available at https://www.jiscmail.ac.uk/policyandsecurity/
