25 | | * |
| 25 | * mmCIF files from Oliver did not work |
| 26 | * Phenix mmCIF is missing entity_polyseq table that specifies SEQRES-equivalent information. Need to guess at what residues are connected and where chain breaks appear. |
| 27 | * COOT dumps a PDB file into an mmCIF atom_site table. No entity_polyseq table. All atoms in same entity with duplicate values in several fields. Works fine in COOT, Phenix and PyMol according to Oliver. |
| 28 | * PDB asks for large files in mmCIF file using Phenix or CCP4. mmCIF from Phenix is first generated and then post-processed into acceptable submission form. Get Oliver to run the Phenix standalone program? (TomG) Also ask about CCP4 and RefMac mmCIF output. |