Content for NMR-STAR saveframe, "shift5"
save_shift5
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode shift5
_Assigned_chem_shift_list.Entry_ID 5333
_Assigned_chem_shift_list.ID 5
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditon
_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 . 5333 5
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 . 5 2 1 1 HEM HHA H 1 9.90 0.02 . 1 . . . . . . . . 5333 5
2 . 5 2 1 1 HEM HHB H 1 9.37 0.02 . 1 . . . . . . . . 5333 5
3 . 5 2 1 1 HEM HHC H 1 9.13 0.02 . 1 . . . . . . . . 5333 5
4 . 5 2 1 1 HEM HHD H 1 9.14 0.02 . 1 . . . . . . . . 5333 5
5 . 5 2 1 1 HEM HMA H 1 3.28 0.02 . 1 . . . . . . . . 5333 5
6 . 5 2 1 1 HEM HMB H 1 3.63 0.02 . 1 . . . . . . . . 5333 5
7 . 5 2 1 1 HEM HMC H 1 3.00 0.02 . 1 . . . . . . . . 5333 5
8 . 5 2 1 1 HEM HMD H 1 3.76 0.02 . 1 . . . . . . . . 5333 5
9 . 5 2 1 1 HEM HAB H 1 6.04 0.02 . 1 . . . . . . . . 5333 5
10 . 5 2 1 1 HEM HAC H 1 6.02 0.02 . 1 . . . . . . . . 5333 5
11 . 5 2 1 1 HEM HBB H 1 1.92 0.02 . 1 . . . . . . . . 5333 5
12 . 5 2 1 1 HEM HBC H 1 0.44 0.02 . 1 . . . . . . . . 5333 5
13 . 5 2 1 1 HEM HAD H 1 4.57 0.02 . 2 . . . . . . . . 5333 5
14 . 5 2 1 1 HEM HADA H 1 4.13 0.02 . 2 . . . . . . . . 5333 5
15 . 5 2 1 1 HEM HBD H 1 3.51 0.02 . 2 . . . . . . . . 5333 5
16 . 5 2 1 1 HEM HBDA H 1 3.85 0.02 . 2 . . . . . . . . 5333 5
17 . 5 2 1 1 HEM HAA H 1 4.76 0.02 . 2 . . . . . . . . 5333 5
18 . 5 2 1 1 HEM HAAA H 1 3.93 0.02 . 2 . . . . . . . . 5333 5
19 . 5 2 1 1 HEM HBA H 1 3.42 0.02 . 2 . . . . . . . . 5333 5
20 . 5 2 1 1 HEM HBAA H 1 2.91 0.02 . 2 . . . . . . . . 5333 5
stop_
save_