diff --git a/modules/io/src/mol/mmcif_reader.cc b/modules/io/src/mol/mmcif_reader.cc index 905e28442bab8bd68300426bdeb99df8c6d4cb0e..2df3966fa93ae8d304333144cee362a4537dc759 100644 --- a/modules/io/src/mol/mmcif_reader.cc +++ b/modules/io/src/mol/mmcif_reader.cc @@ -509,6 +509,9 @@ void MMCifReader::ParseAndAddAtom(const std::vector<StringRef>& columns) if(!curr_residue_) { // unit test update_residue=true; + subst_res_id_ = cif_chain_name + + columns[indices_[AUTH_SEQ_ID]].str() + + columns[indices_[PDBX_PDB_INS_CODE]].str(); } else if (!valid_res_num) { if (indices_[AUTH_SEQ_ID] != -1 && indices_[PDBX_PDB_INS_CODE] != -1) {