Content for NMR-STAR saveframe, "chemical_shift_set_3"
save_chemical_shift_set_3
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chemical_shift_set_3
_Assigned_chem_shift_list.Entry_ID 4647
_Assigned_chem_shift_list.ID 3
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_cond_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
. . 1 $sample_1 . 4647 3
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 3 3 1 1 BAP H1 H 1 7.37 0.01 . 1 . . . . . . . . 4647 3
2 . 3 3 1 1 BAP H2 H 1 7.43 0.01 . 1 . . . . . . . . 4647 3
3 . 3 3 1 1 BAP H3 H 1 7.44 0.01 . 1 . . . . . . . . 4647 3
4 . 3 3 1 1 BAP H4 H 1 7.53 0.01 . 1 . . . . . . . . 4647 3
5 . 3 3 1 1 BAP H5 H 1 7.82 0.01 . 1 . . . . . . . . 4647 3
6 . 3 3 1 1 BAP H6 H 1 8.19 0.01 . 1 . . . . . . . . 4647 3
7 . 3 3 1 1 BAP H7 H 1 5.24 0.01 . 1 . . . . . . . . 4647 3
8 . 3 3 1 1 BAP H8 H 1 3.98 0.01 . 1 . . . . . . . . 4647 3
9 . 3 3 1 1 BAP H9 H 1 4.83 0.01 . 1 . . . . . . . . 4647 3
10 . 3 3 1 1 BAP H101 H 1 5.66 0.01 . 1 . . . . . . . . 4647 3
11 . 3 3 1 1 BAP H102 H 1 5.66 0.01 . 1 . . . . . . . . 4647 3
12 . 3 3 1 1 BAP H11 H 1 6.30 0.01 . 1 . . . . . . . . 4647 3
13 . 3 3 1 1 BAP H12 H 1 6.91 0.01 . 1 . . . . . . . . 4647 3
stop_
save_