Hi Christian, couldn't you simply change the position in a text editor after changing chain IDs in coot? Atom IDs should renumber after reading and writing in coot, but conversion to cif will probably ignore the atom IDs anyway. Greetings Gottfried
On Monday, 07-12-2020 at 19:19 Pavel Afonine wrote: Hi Christian, you can do it in Phenix PDBTools: GUI->Model Tools-> load files then Options->Other modifications look for Rename chain ID. Pavel On Mon, Dec 7, 2020 at 9:49 AM Christian GALICIA wrote: Hello, I'm trying to swap the chain IDs of a structure. I tried changing the IDs in coot and with PDBset, both change labels of the chains but not the atom positions nor numbering.Also, after the pdb file is converted to cif for deposition it displays in pymol in the original position making chain A not to be at the beginning of the sequence. I would appreciate if you would suggest a good way to achieve this. The structure is otherwise finished and will no go any other rounds of refinement. Thanks Christian -- Christian Galicia E-mail: cgali...@vub.be ------------------------- 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 ######################################################################## 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/
