Tag category H_chem_shift_constraint
Key tags (columns):
Tags in table H_chem_shift_constraint:
| Tag | Description | data type | Mandatory |
|---|---|---|---|
| Assembly_atom_ID | Pointer to '_Atom.Assembly_atom_ID' | int | |
| Atom_ID | Pointer to '_Chem_comp_atom.Atom_ID' | atcode | yes |
| Atom_isotope_number | The mass number for the chemical element defined by the tag '_Atom_type' or any of its related tags. | int | |
| Atom_type | The value for this tag is a standard IUPAC abbreviation for an element (i.e. H C P etc). | code | yes |
| Auth_asym_ID | An alternative identifier for Asym_ID that may be provided by an author. | code | |
| Auth_atom_ID | An 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. | code | |
| Auth_comp_ID | An 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. | code | |
| Auth_entity_assembly_ID | An alternative identifier for Entity_assembly_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. | int | |
| Auth_seq_ID | An 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 fo | code | |
| Chem_shift_val | The value for the H chemical shift. | float | yes |
| Chem_shift_val_err | Estimated error in the H chemical shift. | float | yes |
| Comp_ID | Pointer to '_Chem_comp.ID' | code | yes |
| Comp_index_ID | Pointer to '_Entity_comp_index.ID' | int | yes |
| Entity_assembly_ID | Pointer to '_Entity_assembly.ID' | int | yes |
| Entity_ID | Pointer to '_Entity.ID' | int | yes |
| Entry_ID | Pointer to '_Entry.ID' | code | yes |
| H_chem_shift_constraint_list_ID | Pointer to '_H_chem_shift_constraint_list.ID' | int | yes |
| ID | Unique identifier for a reported proton chemical shift constraint in the list contained within one save frame. | int | yes |
| Resonance_ID | Pointer to '_Resonance.ID' | int | |
| Seq_ID | Pointer to '_Entity_poly_seq.Num' | int | yes |
| Sf_ID | Pointer to '_H_chem_shift_constraint_list.Sf_ID' | int | yes |
| Source_experiment_ID | Pointer to '_Experiment.ID' | int | |