Content for NMR-STAR saveframe, "Dbh_50C_Chemical_Shifts_2"
save_Dbh_50C_Chemical_Shifts_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode Dbh_50C_Chemical_Shifts_2
_Assigned_chem_shift_list.Entry_ID 26564
_Assigned_chem_shift_list.ID 4
_Assigned_chem_shift_list.Sample_condition_list_ID 2
_Assigned_chem_shift_list.Sample_condition_list_label $50C
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $2_2-dimethyl-2-silapentane-sulfonic_acid
_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
2 '2D 1H-15N HSQC' . . . 26564 4
3 '2D 1H-15N HSQC' . . . 26564 4
4 '2D 1H-15N HSQC' . . . 26564 4
5 '2D 1H-15N HSQC' . . . 26564 4
6 '3D 1H-15N NOESY' . . . 26564 4
7 '3D HNCO' . . . 26564 4
8 '3D HNCACB' . . . 26564 4
9 '3D HN(CO)CA' . . . 26564 4
10 '3D HN(CA)CO' . . . 26564 4
13 '2D 1H-15N HSQC' . . . 26564 4
14 '2D 1H-15N HSQC' . . . 26564 4
15 '2D 1H-15N HSQC' . . . 26564 4
16 '2D 1H-15N HSQC' . . . 26564 4
18 '2D 1H-15N HSQC' . . . 26564 4
19 '2D 1H-15N HSQC' . . . 26564 4
20 '2D 1H-15N HSQC' . . . 26564 4
21 '2D 1H-15N HSQC' . . . 26564 4
22 '2D 1H-15N HSQC' . . . 26564 4
23 '2D 1H-15N HSQC' . . . 26564 4
25 '3D HNCO' . . . 26564 4
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loop_
_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 $NMRPipe . . 26564 4
2 $CCPNMR_Analysis . . 26564 4
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_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 . 1 1 103 103 ASP H H 1 8.812 0.005 . 1 . . . . 97 ASP H . 26564 4
2 . 1 1 103 103 ASP C C 13 176.698 0.000 . 1 . . . . 97 ASP C . 26564 4
3 . 1 1 103 103 ASP CA C 13 56.618 0.000 . 1 . . . . 97 ASP CA . 26564 4
4 . 1 1 103 103 ASP CB C 13 40.808 0.000 . 1 . . . . 97 ASP CB . 26564 4
5 . 1 1 103 103 ASP N N 15 121.079 0.036 . 1 . . . . 97 ASP N . 26564 4
6 . 1 1 104 104 LYS H H 1 7.522 0.003 . 1 . . . . 98 LYS H . 26564 4
7 . 1 1 104 104 LYS C C 13 174.172 0.000 . 1 . . . . 98 LYS C . 26564 4
8 . 1 1 104 104 LYS CA C 13 55.338 0.016 . 1 . . . . 98 LYS CA . 26564 4
9 . 1 1 104 104 LYS CB C 13 34.927 0.000 . 1 . . . . 98 LYS CB . 26564 4
10 . 1 1 104 104 LYS N N 15 115.523 0.054 . 1 . . . . 98 LYS N . 26564 4
11 . 1 1 106 106 GLU H H 1 9.223 0.005 . 1 . . . . 100 GLU H . 26564 4
12 . 1 1 106 106 GLU C C 13 175.286 0.000 . 1 . . . . 100 GLU C . 26564 4
13 . 1 1 106 106 GLU CA C 13 54.500 0.000 . 1 . . . . 100 GLU CA . 26564 4
14 . 1 1 106 106 GLU CB C 13 31.750 0.000 . 1 . . . . 100 GLU CB . 26564 4
15 . 1 1 106 106 GLU N N 15 127.619 0.062 . 1 . . . . 100 GLU N . 26564 4
16 . 1 1 107 107 VAL H H 1 8.826 0.002 . 1 . . . . 101 VAL H . 26564 4
17 . 1 1 107 107 VAL C C 13 175.682 0.000 . 1 . . . . 101 VAL C . 26564 4
18 . 1 1 107 107 VAL CA C 13 63.021 0.000 . 1 . . . . 101 VAL CA . 26564 4
19 . 1 1 107 107 VAL CB C 13 30.330 0.000 . 1 . . . . 101 VAL CB . 26564 4
20 . 1 1 107 107 VAL N N 15 128.399 0.083 . 1 . . . . 101 VAL N . 26564 4
21 . 1 1 108 108 ALA H H 1 8.280 0.000 . 1 . . . . 102 ALA H . 26564 4
22 . 1 1 108 108 ALA C C 13 177.261 0.000 . 1 . . . . 102 ALA C . 26564 4
23 . 1 1 108 108 ALA CA C 13 53.031 0.000 . 1 . . . . 102 ALA CA . 26564 4
24 . 1 1 108 108 ALA CB C 13 19.669 0.000 . 1 . . . . 102 ALA CB . 26564 4
25 . 1 1 108 108 ALA N N 15 133.903 0.000 . 1 . . . . 102 ALA N . 26564 4
26 . 1 1 109 109 SER H H 1 8.468 0.001 . 1 . . . . 103 SER H . 26564 4
27 . 1 1 109 109 SER CA C 13 56.420 0.000 . 1 . . . . 103 SER CA . 26564 4
28 . 1 1 109 109 SER CB C 13 63.929 0.000 . 1 . . . . 103 SER CB . 26564 4
29 . 1 1 109 109 SER N N 15 111.912 0.012 . 1 . . . . 103 SER N . 26564 4
30 . 1 1 114 114 TYR H H 1 8.941 0.007 . 1 . . . . 108 TYR H . 26564 4
31 . 1 1 114 114 TYR C C 13 174.720 0.000 . 1 . . . . 108 TYR C . 26564 4
32 . 1 1 114 114 TYR CA C 13 57.074 0.000 . 1 . . . . 108 TYR CA . 26564 4
33 . 1 1 114 114 TYR CB C 13 40.780 0.000 . 1 . . . . 108 TYR CB . 26564 4
34 . 1 1 114 114 TYR N N 15 116.003 0.092 . 1 . . . . 108 TYR N . 26564 4
35 . 1 1 115 115 LEU H H 1 10.063 0.005 . 1 . . . . 109 LEU H . 26564 4
36 . 1 1 115 115 LEU C C 13 175.817 0.000 . 1 . . . . 109 LEU C . 26564 4
37 . 1 1 115 115 LEU CA C 13 53.800 0.052 . 1 . . . . 109 LEU CA . 26564 4
38 . 1 1 115 115 LEU N N 15 122.674 0.154 . 1 . . . . 109 LEU N . 26564 4
39 . 1 1 116 116 ASP H H 1 8.663 0.005 . 1 . . . . 110 ASP H . 26564 4
40 . 1 1 116 116 ASP CA C 13 53.358 0.000 . 1 . . . . 110 ASP CA . 26564 4
41 . 1 1 116 116 ASP CB C 13 41.839 0.000 . 1 . . . . 110 ASP CB . 26564 4
42 . 1 1 116 116 ASP N N 15 122.779 0.113 . 1 . . . . 110 ASP N . 26564 4
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save_