##############################################################################
#  This is a dictionary of proposed extensions to the mmCIF dictionary       #
#  for use with the program pdb2cif (H. J. Bernstein, F. C. Bernstein,       #
#  P. E. Bourne, J. Appl. Cryst., 31, to appear, 1988)                       #
#                                                                            #
#  These tokens were used in pdb2cif ***WITHOUT*** the 'pdb2cif' prefix      #
#  through version 2.3.4, (see version 0.0.01 of this dictionary)            #
#                                                                            #
#  This dictionary may be obtained from                                      #
#     ftp://bernstein-plus-sons.com/software/pdb2cif_cif_mm_0.0.02.dic       #
#                                                                            #
#  Comments and suggestions to:  yaya@bernstein-plus-sons.com                #
#                                                                            #
#                                                                            #
##############################################################################


data_pdb2cif_cif_mm.dic

    _dictionary.title           pdb2cif_cif_mm.dic
    _dictionary.version         0.0.02
    _dictionary.datablock_id    pdb2cif_cif_mm.dic


save__struct_conn.pdb2cif_ptnr1_atom_site_id
    _item_description.description
;              The id of an atom site for the first partner in a bond

               This data item is a pointer to _atom_site.id in the
               ATOM_SITE category.
;
    _item.name                  '_struct_conn.pdb2cif_ptnr1_atom_site_id'
    _item.mandatory_code          no
    _item.category_id             struct_conn
    _item_linked.child_name     '_struct_conn.pdb2cif_ptnr1_atom_site_id'
    _item_linked.parent_name    '_atom_site.id'

    _item_aliases.alias_name    '_struct_conn.ptnr1_atom_site_id'
    _item_aliases.dictionary     pdb2cif_cif_mm.dic
    _item_aliases.version       '0.0.01'

     save_

save__struct_conn.pdb2cif_ptnr2_atom_site_id
    _item_description.description
;              The id of an atom site for the second partner in a bond

               This data item is a pointer to _atom_site.id in the
               ATOM_SITE category.
;
    _item.name                  '_struct_conn.pdb2cif_ptnr2_atom_site_id'
    _item.mandatory_code          no
    _item.category_id             struct_conn
    _item_linked.child_name     '_struct_conn.pdb2cif_ptnr2_atom_site_id'
    _item_linked.parent_name    '_atom_site.id'

    _item_aliases.alias_name    '_struct_conn.ptnr2_atom_site_id'
    _item_aliases.dictionary     pdb2cif_cif_mm.dic
    _item_aliases.version       '0.0.01'

     save_

save__atom_site.pdb2cif_label_model_id
    _item_description.description
;              A component of the macromolecular identifier for this 
               atomsite.   The value of _atom_site.label_model_id 
               associates the atom site with a particular nmr model.
;
    _item.name                  '_atom_site.pdb2cif_label_model_id'
    _item.mandatory_code          no
    _item.category_id            'atom_site'
    _item_type.code               code
     loop_
    _item_linked.child_name
    _item_linked.parent_name
         '_struct_mon_prot.pdb2cif_label_model_id'
             '_atom_site.pdb2cif_label_model_id'
         '_struct_mon_prot_cis.pdb2cif_label_model_id'
             '_atom_site.pdb2cif_label_model_id'

    _item_aliases.alias_name    '_atom_site.label_model_id'
    _item_aliases.dictionary     pdb2cif_cif_mm.dic
    _item_aliases.version       '0.0.01'

     save_


save__struct_mon_prot.pdb2cif_label_model_id
    _item_description.description
;              This data item is a pointer to _atom_site.label_model_id 
               in  the ATOM_SITE category.
;
    _item.name                  '_struct_mon_prot.pdb2cif_label_model_id'
    _item.mandatory_code          no
    _item.category_id             struct_mon_prot

    _item_aliases.alias_name    '_struct_mon_prot.label_model_id'
    _item_aliases.dictionary     pdb2cif_cif_mm.dic
    _item_aliases.version       '0.0.01'

     save_

save__struct_mon_prot_cis.pdb2cif_label_model_id
    _item_description.description
;              This data item is a pointer to _atom_site.label_model_id 
               in the ATOM_SITE category.
;
    _item.name              '_struct_mon_prot_cis.pdb2cif_label_model_id'
    _item.mandatory_code          no
    _item.category_id             struct_mon_prot_cis

    _item_aliases.alias_name    '_struct_mon_prot_cis.label_model_id'
    _item_aliases.dictionary     pdb2cif_cif_mm.dic
    _item_aliases.version       '0.0.01'

     save_

save__struct_ref_seq_dif.pdb2cif_db_seq_num
    _item_description.description
;              The sequence position in the referenced database entry
               corresponding to this point difference position.

               The use of . for _struct_ref_seq_dif.pdb2cif_db_seq_num 
               when a value has been given for 
               _struct_ref_seq_dif.seq_num indicates that there 
               has been an insertion at this position.

               The use of . for _struct_ref_seq_dif.seq_num when
               a value is given for _struct_ref_seq_dif.pdb2cif_db_seq_num
               indicates that there has been a deletion at this
               position.
;
    _item.name                  '_struct_ref_seq_dif.pdb2cif_db_seq_num'
    _item.mandatory_code          no
    _item.category_id             struct_ref_seq_dif
     loop_
    _item_range.maximum
    _item_range.minimum
                                  .    1
                                  1    1
    _item_type.code               int


    _item_aliases.alias_name    '_struct_ref_seq_dif.db_seq_num'
    _item_aliases.dictionary     pdb2cif_cif_mm.dic
    _item_aliases.version       '0.0.01'


     save_


########################
## DICTIONARY_HISTORY ##
########################

     loop_
    _dictionary_history.version
    _dictionary_history.update
    _dictionary_history.revision
   '0.0.01'  '1997-12-16'
;
   Dictionary created with tokens in use in pdb2cif version 2.3.4
;
   '0.0.02'  '1997-12-16'
;
   Dictionary revised to use 'pdb2cif' prefix to conform to update policy
;