diff --git a/modules/io/doc/mmcif.rst b/modules/io/doc/mmcif.rst index f629524f976429dfe2c81ce8b4564e542c6e12b4..203bb2961b08fd8db282a5ba5340f612b015155b 100644 --- a/modules/io/doc/mmcif.rst +++ b/modules/io/doc/mmcif.rst @@ -79,10 +79,11 @@ Notes: ("label_asym_id", "label_seq_id") and ("auth_asym_id", "auth_seq_id", "pdbx_PDB_ins_code"). The following data items are available: + * ``atom_site.label_asym_id``: ``residue.chain.name`` * ``atom_site.label_seq_id``: ``residue.GetStringProp("resnum")`` (this is the same as ``residue.number`` for residues in polymer chains. - However, for ligands ``residue.number`` is unset in mmCIF, but it + However, for ligands ``residue.number`` is unset in mmCIF, but it is set to 1 by openstructure.) * ``atom_site.label_entity_id``: ``residue.GetStringProp("entity_id")`` * ``atom_site.auth_asym_id``: ``residue.GetStringProp("pdb_auth_chain_name")``