Content for NMR-STAR saveframe, "assigned_chemical_shifts_2"
save_assigned_chemical_shifts_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_2
_Assigned_chem_shift_list.Entry_ID 51923
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Name 'Tamsulosin - alt. Conf. 1'
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err 0.001
_Assigned_chem_shift_list.Chem_shift_13C_err 0.01
_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 .
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_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 '2D 1H-13C HSQC' . . . 51923 2
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_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
1 $software_1 . . 51923 2
2 $software_2 . . 51923 2
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_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_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.Ambiguity_set_ID
_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 . 1 . 1 30 30 ILE HD11 H 1 0.374 . . 1 . . . . . 60 ILE HD11 . 51923 2
2 . 1 . 1 30 30 ILE HD12 H 1 0.374 . . 1 . . . . . 60 ILE HD12 . 51923 2
3 . 1 . 1 30 30 ILE HD13 H 1 0.374 . . 1 . . . . . 60 ILE HD13 . 51923 2
4 . 1 . 1 30 30 ILE CD1 C 13 13.909 . . 1 . . . . . 60 ILE CD1 . 51923 2
5 . 1 . 1 148 148 ILE HD11 H 1 0.777 . . 1 . . . . . 178 ILE HD11 . 51923 2
6 . 1 . 1 148 148 ILE HD12 H 1 0.777 . . 1 . . . . . 178 ILE HD12 . 51923 2
7 . 1 . 1 148 148 ILE HD13 H 1 0.777 . . 1 . . . . . 178 ILE HD13 . 51923 2
8 . 1 . 1 148 148 ILE CD1 C 13 12.038 . . 1 . . . . . 178 ILE CD1 . 51923 2
9 . 1 . 1 189 189 ILE HD11 H 1 0.618 . . 5 . . . . . 219 ILE HD11 . 51923 2
10 . 1 . 1 189 189 ILE HD12 H 1 0.618 . . 5 . . . . . 219 ILE HD12 . 51923 2
11 . 1 . 1 189 189 ILE HD13 H 1 0.618 . . 5 . . . . . 219 ILE HD13 . 51923 2
12 . 1 . 1 189 189 ILE CD1 C 13 14.702 . . 5 . . . . . 219 ILE CD1 . 51923 2
13 . 1 . 1 229 229 ILE HD11 H 1 0.690 . . 1 . . . . . 304 ILE HD11 . 51923 2
14 . 1 . 1 229 229 ILE HD12 H 1 0.690 . . 1 . . . . . 304 ILE HD12 . 51923 2
15 . 1 . 1 229 229 ILE HD13 H 1 0.690 . . 1 . . . . . 304 ILE HD13 . 51923 2
16 . 1 . 1 229 229 ILE CD1 C 13 14.407 . . 1 . . . . . 304 ILE CD1 . 51923 2
17 . 1 . 1 271 271 ILE HD11 H 1 0.902 . . 1 . . . . . 346 ILE HD11 . 51923 2
18 . 1 . 1 271 271 ILE HD12 H 1 0.902 . . 1 . . . . . 346 ILE HD12 . 51923 2
19 . 1 . 1 271 271 ILE HD13 H 1 0.902 . . 1 . . . . . 346 ILE HD13 . 51923 2
20 . 1 . 1 271 271 ILE CD1 C 13 12.563 . . 1 . . . . . 346 ILE CD1 . 51923 2
stop_
save_