Content for NMR-STAR saveframe, "assigned_chemical_shifts_three"
save_assigned_chemical_shifts_three
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_three
_Assigned_chem_shift_list.Entry_ID 4129
_Assigned_chem_shift_list.ID 3
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_one
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_one
_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
;
The amide proton assignments in the natural sample (sample_two) which differ by
more than 0.05 ppm from the values in the recombinant sample.
;
_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
. . 2 $sample_two . 4129 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 . 2 1 5 5 VAL H H 1 9.08 0.01 . 1 . . . . . . . . 4129 3
2 . 2 1 7 7 LYS H H 1 8.81 0.01 . 1 . . . . . . . . 4129 3
3 . 2 1 8 8 MET H H 1 8.24 0.01 . 1 . . . . . . . . 4129 3
4 . 2 1 9 9 LYS H H 1 8.95 0.01 . 1 . . . . . . . . 4129 3
5 . 2 1 80 80 LYS H H 1 8.73 0.01 . 1 . . . . . . . . 4129 3
6 . 2 1 84 84 LYS H H 1 6.88 0.01 . 1 . . . . . . . . 4129 3
7 . 2 1 114 114 ASP H H 1 8.34 0.01 . 1 . . . . . . . . 4129 3
8 . 2 1 159 159 MET H H 1 8.83 0.01 . 1 . . . . . . . . 4129 3
9 . 2 1 160 160 ASN H H 1 8.35 0.01 . 1 . . . . . . . . 4129 3
10 . 2 1 161 161 ASP H H 1 9.27 0.01 . 1 . . . . . . . . 4129 3
11 . 2 1 162 162 GLY H H 1 8.83 0.01 . 1 . . . . . . . . 4129 3
stop_
save_