Dear Christian

What exactly are you trying to accomplish?


I don't quite follow why you would expect the atom positions to change?
Unless I'm missing something?
Also, why would you expect the numbering to change when you edit the chain
ID?

After CIF conversion:
What do you mean by "original position"? What position where you expecting?

And you mention that chain A is not at the beginning of the sequence. What
sequence are you talking about?

Coot or pdbset can definitely do want you want, I'm just not sure what
exactly you're after.

Perhaps a more elaborate explanation would be good?

Best regards
Folmer Fredslund


man. 7. dec. 2020 18.49 skrev Christian GALICIA <
christian.galicia.diaz.sant...@vub.be>:

> 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
>
>
>
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