data_GTE
# 
_chem_comp.id                                    GTE 
_chem_comp.name                                  "GLUCOSE 4-O4 GROUP" 
_chem_comp.type                                  SACCHARIDE 
_chem_comp.pdbx_type                             ATOMS 
_chem_comp.formula                               "H O" 
_chem_comp.mon_nstd_parent_comp_id               ? 
_chem_comp.pdbx_synonyms                         ? 
_chem_comp.pdbx_formal_charge                    0 
_chem_comp.pdbx_initial_date                     1999-07-08 
_chem_comp.pdbx_modified_date                    2008-10-14 
_chem_comp.pdbx_ambiguous_flag                   Y 
_chem_comp.pdbx_release_status                   OBS 
_chem_comp.pdbx_replaced_by                      ? 
_chem_comp.pdbx_replaces                         ? 
_chem_comp.formula_weight                        17.007 
_chem_comp.one_letter_code                       ? 
_chem_comp.three_letter_code                     GTE 
_chem_comp.pdbx_model_coordinates_details        ? 
_chem_comp.pdbx_model_coordinates_missing_flag   N 
_chem_comp.pdbx_ideal_coordinates_details        ? 
_chem_comp.pdbx_ideal_coordinates_missing_flag   N 
_chem_comp.pdbx_model_coordinates_db_code        ? 
_chem_comp.pdbx_subcomponent_list                ? 
_chem_comp.pdbx_processing_site                  RCSB 
# 
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 
GTE O4  O4  O 0 1 N N N -0.064 0.000 0.000  -0.064 0.000 0.000  O4  GTE 1 
GTE HO4 HO4 H 0 1 N N N 0.512  0.000 -0.776 0.512  0.000 -0.776 HO4 GTE 2 
# 
_chem_comp_bond.comp_id              GTE 
_chem_comp_bond.atom_id_1            O4 
_chem_comp_bond.atom_id_2            HO4 
_chem_comp_bond.value_order          SING 
_chem_comp_bond.pdbx_aromatic_flag   N 
_chem_comp_bond.pdbx_stereo_config   N 
_chem_comp_bond.pdbx_ordinal         1 
# 
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 
GTE SMILES           ACDLabs              10.04 O                         
GTE InChI            InChI                1.02b InChI=1/H2O/h1H2          
GTE InChIKey         InChI                1.02b XLYOFNOQVPJJNP-UHFFFAOYAF 
GTE SMILES_CANONICAL CACTVS               3.341 "[OH]"                    
GTE SMILES           CACTVS               3.341 "[OH]"                    
GTE SMILES_CANONICAL "OpenEye OEToolkits" 1.5.0 "[OH]"                    
GTE SMILES           "OpenEye OEToolkits" 1.5.0 "[OH]"                    
# 
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 
GTE "SYSTEMATIC NAME" ACDLabs              10.04 water            
GTE "SYSTEMATIC NAME" "OpenEye OEToolkits" 1.5.0 "$l^{1}-oxidane" 
# 
loop_
_pdbx_chem_comp_audit.comp_id 
_pdbx_chem_comp_audit.action_type 
_pdbx_chem_comp_audit.date 
_pdbx_chem_comp_audit.processing_site 
GTE "Create component" 1999-07-08 RCSB 
# 
