Content for NMR-STAR saveframe, "shift_set_2"
save_shift_set_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode shift_set_2
_Assigned_chem_shift_list.Entry_ID 5981
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $condition_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 $unl-DHFR-TMP-NADPH . 5981 2
. . 2 $13C-15N-DHFR-TMP-NADPH . 5981 2
. . 3 $15N-DHFR-TMP-NADPH . 5981 2
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 2 1 1 NAP 1HN4 H 1 11.893 0.007 . 2 . . . . . . . . 5981 2
2 . 3 2 1 1 NAP 2HN4 H 1 6.904 0.006 . 2 . . . . . . . . 5981 2
3 . 3 2 1 1 NAP 1HN7 H 1 9.203 0.000 . 2 . . . . . . . . 5981 2
4 . 3 2 1 1 NAP H1 H 1 6.286 0.007 . 1 . . . . . . . . 5981 2
5 . 3 2 1 1 NAP 1H9 H 1 2.542 0.012 . 2 . . . . . . . . 5981 2
6 . 3 2 1 1 NAP 2H9 H 1 3.356 0.005 . 2 . . . . . . . . 5981 2
7 . 3 2 1 1 NAP H11 H 1 5.775 0.008 . 1 . . . . . . . . 5981 2
8 . 3 2 1 1 NAP 1H14 H 1 3.546 0.012 . 1 . . . . . . . . 5981 2
9 . 3 2 1 1 NAP 2H14 H 1 3.546 0.012 . 1 . . . . . . . . 5981 2
10 . 3 2 1 1 NAP 3H14 H 1 3.546 0.012 . 1 . . . . . . . . 5981 2
11 . 3 2 1 1 NAP 1H17 H 1 3.515 0.001 . 1 . . . . . . . . 5981 2
12 . 3 2 1 1 NAP 2H17 H 1 3.515 0.001 . 1 . . . . . . . . 5981 2
13 . 3 2 1 1 NAP 3H17 H 1 3.515 0.001 . 1 . . . . . . . . 5981 2
14 . 3 2 1 1 NAP 1H20 H 1 3.558 0.007 . 1 . . . . . . . . 5981 2
15 . 3 2 1 1 NAP 2H20 H 1 3.558 0.007 . 1 . . . . . . . . 5981 2
16 . 3 2 1 1 NAP 3H20 H 1 3.558 0.007 . 1 . . . . . . . . 5981 2
17 . 3 2 1 1 NAP H21 H 1 5.767 0.000 . 1 . . . . . . . . 5981 2
stop_
save_