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wujiewang avatar wujiewang commented on September 27, 2024 1

We don't use ChimeraX, so we are not aware of the problem. We will try to look into it.

For the generated Protein Object, you can also dump to pdb directly with .to_PDB() if that is easier.

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wujiewang avatar wujiewang commented on September 27, 2024 1

@Guillawme @agarrubio

hey, @ggrigoryanv fixed the write_CIF functions by adding atom elemnt types with 2f3f32a. I tested it and it works. You can get the change by installing from github.

Thanks so much for the feedback.

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Guillawme avatar Guillawme commented on September 27, 2024

I get the exact same error when trying to open the corresponding protein.cif.txt file with ChimeraX. Also opens fine in PyMOL.

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agarrubio avatar agarrubio commented on September 27, 2024

I have the same problem. I had to convert that 'cif' to 'pdb':
https://mmcif.pdbj.org/converter/index.php?l=en

There is also this software, which I haven't tried:
https://github.com/PDB-REDO/cif-tools

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