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Tag category Assigned_peak_chem_shift

Key tags (columns):

Tags in table Assigned_peak_chem_shift:

TagDescriptiondata typeMandatory
Ambiguity_codeAmbiguity codes are used to define chemical shifts that have not been assigned to specific atoms in the molecule studied. Ambiguity in chemical shifts may exist at several different levels stereospecific ambiguity intra and inter residue ambiguities eint 
Ambiguity_set_IDThe ambiguity_set_ID defines those chemical shifts with ambiguity codes of 4 5 or 6 that form a known set of related chemical shift assignments.int 
Assembly_atom_IDPointer to '_Atom.Assembly_atom_ID'int 
Assigned_chem_shift_list_IDPointer to '_Assigned_chem_shift_list.ID'int 
Atom_chem_shift_IDPointer to '_Atom_chem_shift.ID'int 
Atom_IDPointer to '_Chem_comp_atom.Atom_ID'atcode 
Auth_amb_atom_grp_IDThe author defined unque identifier that identifies a grouping of chemical shifts with ambiguity codes of 4 5 or 6.int 
Auth_ambiguity_codeAmbiguity codes are used to define chemical shifts that have not been assigned to specific atoms in the molecule studied. Ambiguity in chemical shifts may exist at several different levels stereospecific ambiguity intra and inter residue ambiguities ecode 
Auth_ambiguity_set_IDThe ambiguity_set_ID defines those chemical shifts with ambiguity codes of 4 5 or 6 that form a known set of related chemical shift assignments.code 
Auth_atom_IDAn alternative identifier for Atom_ID that may be provided by an author in order to match that used in the publication that describes the experimental data.line 
Auth_atom_peak_numAn alternative identifier found in the original peak list data that is a pointer to information in another author provided data table or file. Note that the value does not need to to the value for Peak_ID.int 
Auth_comp_IDAn alternative identifier for Comp_ID that may be provided by an author in order to match that used in the publication that describes the experimental data.line 
Auth_entity_IDAn alternative identifier for Entity_ID that may be provided by an author in order to match that used in the publication that describes the experimental data. Note that the value is not required to be a number and does not need to correspond to the valueline 
Auth_seq_IDAn alternative identifier for Seq_ID that may be provided by an author in order to match that used in the publication that describes the experimental data. Note that the value is not required to be a number and does not need to correspond to the value foline 
Comp_IDPointer to '_Chem_comp.ID'code 
Comp_index_IDPointer to '_Entity_comp_index.ID'int 
Contribution_fractional_valThe fraction of a peak assigned to this peak ID.float 
DetailsText describing the reported spectral peak assignment.text 
Entity_assembly_IDPointer to '_Entity_assembly.ID'int 
Entity_IDPointer to '_Entity.ID'int 
Entry_IDPointer to '_Entry.ID'codeyes
Figure_of_meritFigure of merit for the assignment of the atom to the reported chemical shift value.float 
Magnetization_linkage_IDThe Magnetization linkage ID is used to group peaks that may be related through a magnetization transfer event.int 
Peak_IDPointer to '_Peak.ID'intyes
Resonance_IDPointer to '_Resonance.ID'int 
Set_IDThe Set ID allows assigned peaks to be grouped. This might be by spin-system or other form of grouping implemented by software or by the user.intyes
Sf_IDPointer to '_Spectral_peak_list.Sf_ID'intyes
Spectral_dim_IDPointer to '_Spectral_dim.ID'intyes
Spectral_peak_list_IDPointer to '_Spectral_peak_list.ID'intyes
ValThe quantitative chemical shift value assigned to the peak.float