data_Z0F
#

_chem_comp.id                                   Z0F
_chem_comp.name                                 alpha-L-idopyranose
_chem_comp.type                                 "L-saccharide, alpha linking"
_chem_comp.pdbx_type                            ATOMS
_chem_comp.formula                              "C6 H12 O6"
_chem_comp.mon_nstd_parent_comp_id              ?
_chem_comp.pdbx_synonyms                        "alpha-L-idose; L-idose; idose"
_chem_comp.pdbx_formal_charge                   0
_chem_comp.pdbx_initial_date                    2012-12-18
_chem_comp.pdbx_modified_date                   2020-07-17
_chem_comp.pdbx_ambiguous_flag                  N
_chem_comp.pdbx_release_status                  REL
_chem_comp.pdbx_replaced_by                     ?
_chem_comp.pdbx_replaces                        ?
_chem_comp.formula_weight                       180.156
_chem_comp.one_letter_code                      ?
_chem_comp.three_letter_code                    Z0F
_chem_comp.pdbx_model_coordinates_details       ?
_chem_comp.pdbx_model_coordinates_missing_flag  N
_chem_comp.pdbx_ideal_coordinates_details       Corina
_chem_comp.pdbx_ideal_coordinates_missing_flag  N
_chem_comp.pdbx_model_coordinates_db_code       3DDL
_chem_comp.pdbx_subcomponent_list               ?
_chem_comp.pdbx_processing_site                 RCSB
#   #
loop_
_pdbx_chem_comp_synonyms.ordinal
_pdbx_chem_comp_synonyms.comp_id
_pdbx_chem_comp_synonyms.name
_pdbx_chem_comp_synonyms.provenance
_pdbx_chem_comp_synonyms.type
1  Z0F  alpha-L-idose  PDB  ?  
2  Z0F  L-idose        PDB  ?  
3  Z0F  idose          PDB  ?  
#   #
loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.alt_atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.charge
_chem_comp_atom.pdbx_align
_chem_comp_atom.pdbx_aromatic_flag
_chem_comp_atom.pdbx_leaving_atom_flag
_chem_comp_atom.pdbx_stereo_config
_chem_comp_atom.model_Cartn_x
_chem_comp_atom.model_Cartn_y
_chem_comp_atom.model_Cartn_z
_chem_comp_atom.pdbx_model_Cartn_x_ideal
_chem_comp_atom.pdbx_model_Cartn_y_ideal
_chem_comp_atom.pdbx_model_Cartn_z_ideal
_chem_comp_atom.pdbx_component_atom_id
_chem_comp_atom.pdbx_component_comp_id
_chem_comp_atom.pdbx_ordinal
Z0F  C1   C1   C  0  1  N  N  R  43.661  20.507  65.287   0.737  -1.094   0.930  C1   Z0F   1  
Z0F  C2   C2   C  0  1  N  N  R  44.615  20.471  66.525   1.739  -0.027   0.482  C2   Z0F   2  
Z0F  C3   C3   C  0  1  N  N  S  45.954  21.215  66.195   1.335   0.494  -0.900  C3   Z0F   3  
Z0F  C4   C4   C  0  1  N  N  S  46.727  20.561  65.013  -0.097   1.033  -0.832  C4   Z0F   4  
Z0F  C5   C5   C  0  1  N  N  S  45.772  19.843  64.004  -1.028  -0.075  -0.334  C5   Z0F   5  
Z0F  C6   C6   C  0  1  N  N  N  46.337  19.839  62.566  -2.451   0.473  -0.206  C6   Z0F   6  
Z0F  O1   O1   O  0  1  N  Y  N  42.734  19.332  65.324   0.778  -2.197   0.022  O1   Z0F   7  
Z0F  O2   O2   O  0  1  N  N  N  43.970  21.102  67.642   1.737   1.053   1.418  O2   Z0F   8  
Z0F  O3   O3   O  0  1  N  N  N  46.796  21.258  67.362   1.400  -0.572  -1.850  O3   Z0F   9  
Z0F  O4   O4   O  0  1  N  N  N  47.495  21.577  64.344  -0.148   2.141   0.069  O4   Z0F  10  
Z0F  O5   O5   O  0  1  N  N  N  44.438  20.472  64.042  -0.579  -0.535   0.942  O5   Z0F  11  
Z0F  O6   O6   O  0  1  N  N  N  46.381  18.490  62.034  -3.341  -0.588   0.146  O6   Z0F  12  
Z0F  H1   H1   H  0  1  N  N  N  43.072  21.435  65.329   0.995  -1.437   1.932  H1   Z0F  13  
Z0F  HO1  H1O  H  0  1  N  Y  N  42.229  19.351  66.129   0.166  -2.912   0.245  HO1  Z0F  14  
Z0F  H2   H2   H  0  1  N  N  N  44.846  19.421  66.760   2.736  -0.463   0.430  H2   Z0F  15  
Z0F  HO2  H2O  H  0  1  N  Y  N  44.548  21.081  68.395   1.979   0.794   2.318  HO2  Z0F  16  
Z0F  H3   H3   H  0  1  N  N  N  45.697  22.242  65.898   2.012   1.294  -1.201  H3   Z0F  17  
Z0F  HO3  H3O  H  0  1  N  Y  N  47.605  21.710  67.153   2.278  -0.966  -1.940  HO3  Z0F  18  
Z0F  H4   H4   H  0  1  N  N  N  47.407  19.804  65.431  -0.413   1.355  -1.825  H4   Z0F  19  
Z0F  HO4  H4O  H  0  1  N  Y  N  47.972  21.189  63.620   0.423   2.880  -0.183  HO4  Z0F  20  
Z0F  H5   H5   H  0  1  N  N  N  45.675  18.796  64.328  -1.020  -0.903  -1.043  H5   Z0F  21  
Z0F  H61  H61  H  0  1  N  N  N  45.694  20.459  61.924  -2.477   1.241   0.567  H61  Z0F  22  
Z0F  H62  H62  H  0  1  N  N  N  47.355  20.256  62.577  -2.761   0.906  -1.158  H62  Z0F  23  
Z0F  HO6  H6O  H  0  1  N  Y  N  46.731  18.509  61.151  -4.262  -0.312   0.244  HO6  Z0F  24  
#   #
loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.value_order
_chem_comp_bond.pdbx_aromatic_flag
_chem_comp_bond.pdbx_stereo_config
_chem_comp_bond.pdbx_ordinal
Z0F  C1  O5   SING  N  N   1  
Z0F  C1  C2   SING  N  N   2  
Z0F  C1  O1   SING  N  N   3  
Z0F  C1  H1   SING  N  N   4  
Z0F  C2  C3   SING  N  N   5  
Z0F  C2  O2   SING  N  N   6  
Z0F  C2  H2   SING  N  N   7  
Z0F  C3  C4   SING  N  N   8  
Z0F  C3  O3   SING  N  N   9  
Z0F  C3  H3   SING  N  N  10  
Z0F  C4  C5   SING  N  N  11  
Z0F  C4  O4   SING  N  N  12  
Z0F  C4  H4   SING  N  N  13  
Z0F  C5  H5   SING  N  N  14  
Z0F  C5  O5   SING  N  N  15  
Z0F  C5  C6   SING  N  N  16  
Z0F  C6  H61  SING  N  N  17  
Z0F  C6  O6   SING  N  N  18  
Z0F  C6  H62  SING  N  N  19  
Z0F  O1  HO1  SING  N  N  20  
Z0F  O2  HO2  SING  N  N  21  
Z0F  O3  HO3  SING  N  N  22  
Z0F  O4  HO4  SING  N  N  23  
Z0F  O6  HO6  SING  N  N  24  
#   #
loop_
_pdbx_chem_comp_descriptor.comp_id
_pdbx_chem_comp_descriptor.type
_pdbx_chem_comp_descriptor.program
_pdbx_chem_comp_descriptor.program_version
_pdbx_chem_comp_descriptor.descriptor
Z0F  SMILES            ACDLabs               12.01  "OC1C(O)C(OC(O)C1O)CO"  
Z0F  InChI             InChI                 1.03   "InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3+,4-,5+,6+/m0/s1"  
Z0F  InChIKey          InChI                 1.03   WQZGKKKJIJFFOK-DSOBHZJASA-N  
Z0F  SMILES_CANONICAL  CACTVS                3.370  "OC[C@@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O"  
Z0F  SMILES            CACTVS                3.370  "OC[CH]1O[CH](O)[CH](O)[CH](O)[CH]1O"  
Z0F  SMILES_CANONICAL  "OpenEye OEToolkits"  1.7.6  "C([C@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O)O)O)O)O"  
Z0F  SMILES            "OpenEye OEToolkits"  1.7.6  "C(C1C(C(C(C(O1)O)O)O)O)O"  
#   #
loop_
_pdbx_chem_comp_identifier.comp_id
_pdbx_chem_comp_identifier.type
_pdbx_chem_comp_identifier.program
_pdbx_chem_comp_identifier.program_version
_pdbx_chem_comp_identifier.identifier
Z0F  "SYSTEMATIC NAME"                      ACDLabs               12.01  alpha-L-idopyranose  
Z0F  "SYSTEMATIC NAME"                      "OpenEye OEToolkits"  1.7.6  "(2R,3R,4S,5S,6S)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol"  
Z0F  "CONDENSED IUPAC CARBOHYDRATE SYMBOL"  GMML                  1.0    LIdopa  
Z0F  "COMMON NAME"                          GMML                  1.0    a-L-idopyranose  
Z0F  "IUPAC CARBOHYDRATE SYMBOL"            PDB-CARE              1.0    a-L-Idop  
Z0F  "SNFG CARBOHYDRATE SYMBOL"             GMML                  1.0    Ido  
#   #
loop_
_pdbx_chem_comp_feature.comp_id
_pdbx_chem_comp_feature.type
_pdbx_chem_comp_feature.value
_pdbx_chem_comp_feature.source
_pdbx_chem_comp_feature.support
Z0F  "CARBOHYDRATE ISOMER"                  L         PDB  ?  
Z0F  "CARBOHYDRATE RING"                    pyranose  PDB  ?  
Z0F  "CARBOHYDRATE ANOMER"                  alpha     PDB  ?  
Z0F  "CARBOHYDRATE PRIMARY CARBONYL GROUP"  aldose    PDB  ?  
#   #
loop_
_pdbx_chem_comp_audit.comp_id
_pdbx_chem_comp_audit.action_type
_pdbx_chem_comp_audit.date
_pdbx_chem_comp_audit.processing_site
Z0F  "Create component"          2012-12-18  RCSB  
Z0F  "Modify atom id"            2013-03-03  RCSB  
Z0F  "Other modification"        2019-08-12  RCSB  
Z0F  "Other modification"        2019-12-19  RCSB  
Z0F  "Other modification"        2020-06-03  RCSB  
Z0F  "Other modification"        2020-06-10  RCSB  
Z0F  "Other modification"        2020-07-03  RCSB  
Z0F  "Modify atom id"            2020-07-17  RCSB  
Z0F  "Modify component atom id"  2020-07-17  RCSB  
Z0F  "Initial release"           2020-07-29  RCSB  
##
