Content for NMR-STAR saveframe, "assigned_chem_shift_list_2"
save_assigned_chem_shift_list_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_2
_Assigned_chem_shift_list.Entry_ID 19247
_Assigned_chem_shift_list.ID 2
_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 $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err 0.01
_Assigned_chem_shift_list.Chem_shift_13C_err 0.1
_Assigned_chem_shift_list.Chem_shift_15N_err 0.2
_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 'Estimated from the spectral resolution after zero filling.'
_Assigned_chem_shift_list.Details
;
Some residues have double resonances due to partially processed N-terminal methionine.
Side chain resonance assignments were taken from the following reference:
Christian Lange et al. Biochimica et Biophysica Acta 1707 (2005)179-188.
;
_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 '3D HNCACB' . . . 19247 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_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 3 3 ILE CA C 13 59.731 0.1 . 9 . . . . 1 ILE CA . 19247 2
2 . 1 1 3 3 ILE CB C 13 40.898 0.1 . 9 . . . . 1 ILE CB . 19247 2
3 . 1 1 4 4 ASP H H 1 7.793 0.01 . 9 . . . . 2 ASP H . 19247 2
4 . 1 1 4 4 ASP CA C 13 52.866 0.1 . 9 . . . . 2 ASP CA . 19247 2
5 . 1 1 4 4 ASP CB C 13 42.052 0.1 . 9 . . . . 2 ASP CB . 19247 2
6 . 1 1 4 4 ASP N N 15 126.557 0.2 . 9 . . . . 2 ASP N . 19247 2
7 . 1 1 5 5 VAL H H 1 8.810 0.01 . 9 . . . . 3 VAL H . 19247 2
8 . 1 1 5 5 VAL CA C 13 60.624 0.1 . 9 . . . . 3 VAL CA . 19247 2
9 . 1 1 5 5 VAL CB C 13 34.860 0.1 . 9 . . . . 3 VAL CB . 19247 2
10 . 1 1 5 5 VAL N N 15 124.473 0.2 . 9 . . . . 3 VAL N . 19247 2
11 . 1 1 22 22 SER H H 1 8.592 0.01 . 9 . . . . 20 SER H . 19247 2
12 . 1 1 22 22 SER CA C 13 56.744 0.1 . 9 . . . . 20 SER CA . 19247 2
13 . 1 1 22 22 SER CB C 13 66.301 0.1 . 9 . . . . 20 SER CB . 19247 2
14 . 1 1 22 22 SER N N 15 115.606 0.2 . 9 . . . . 20 SER N . 19247 2
15 . 1 1 23 23 ILE CA C 13 59.708 0.1 . 9 . . . . 21 ILE CA . 19247 2
16 . 1 1 23 23 ILE CB C 13 43.036 0.1 . 9 . . . . 21 ILE CB . 19247 2
17 . 1 1 24 24 SER H H 1 8.406 0.01 . 9 . . . . 22 SER H . 19247 2
18 . 1 1 24 24 SER CA C 13 56.786 0.1 . 9 . . . . 22 SER CA . 19247 2
19 . 1 1 24 24 SER CB C 13 63.291 0.1 . 9 . . . . 22 SER CB . 19247 2
20 . 1 1 24 24 SER N N 15 117.743 0.2 . 9 . . . . 22 SER N . 19247 2
21 . 1 1 25 25 PRO CA C 13 64.389 0.1 . 9 . . . . 23 PRO CA . 19247 2
22 . 1 1 25 25 PRO CB C 13 31.488 0.1 . 9 . . . . 23 PRO CB . 19247 2
23 . 1 1 26 26 GLY H H 1 9.216 0.01 . 9 . . . . 24 GLY H . 19247 2
24 . 1 1 26 26 GLY CA C 13 44.977 0.1 . 9 . . . . 24 GLY CA . 19247 2
25 . 1 1 26 26 GLY N N 15 113.639 0.2 . 9 . . . . 24 GLY N . 19247 2
26 . 1 1 27 27 GLU H H 1 7.655 0.01 . 9 . . . . 25 GLU H . 19247 2
27 . 1 1 27 27 GLU CA C 13 56.991 0.1 . 9 . . . . 25 GLU CA . 19247 2
28 . 1 1 27 27 GLU CB C 13 31.063 0.1 . 9 . . . . 25 GLU CB . 19247 2
29 . 1 1 27 27 GLU N N 15 122.031 0.2 . 9 . . . . 25 GLU N . 19247 2
30 . 1 1 28 28 LYS H H 1 7.981 0.01 . 9 . . . . 26 LYS H . 19247 2
31 . 1 1 28 28 LYS CA C 13 56.195 0.1 . 9 . . . . 26 LYS CA . 19247 2
32 . 1 1 28 28 LYS CB C 13 33.986 0.1 . 9 . . . . 26 LYS CB . 19247 2
33 . 1 1 28 28 LYS N N 15 120.767 0.2 . 9 . . . . 26 LYS N . 19247 2
34 . 1 1 29 29 ILE H H 1 8.867 0.01 . 9 . . . . 27 ILE H . 19247 2
35 . 1 1 29 29 ILE CA C 13 60.343 0.1 . 9 . . . . 27 ILE CA . 19247 2
36 . 1 1 29 29 ILE CB C 13 39.643 0.1 . 9 . . . . 27 ILE CB . 19247 2
37 . 1 1 29 29 ILE N N 15 125.962 0.2 . 9 . . . . 27 ILE N . 19247 2
38 . 1 1 30 30 VAL H H 1 8.468 0.01 . 9 . . . . 28 VAL H . 19247 2
39 . 1 1 30 30 VAL CA C 13 61.645 0.1 . 9 . . . . 28 VAL CA . 19247 2
40 . 1 1 30 30 VAL CB C 13 31.394 0.1 . 9 . . . . 28 VAL CB . 19247 2
41 . 1 1 30 30 VAL N N 15 126.622 0.2 . 9 . . . . 28 VAL N . 19247 2
42 . 1 1 32 32 LYS H H 1 9.173 0.01 . 9 . . . . 30 LYS H . 19247 2
43 . 1 1 32 32 LYS CA C 13 54.839 0.1 . 9 . . . . 30 LYS CA . 19247 2
44 . 1 1 32 32 LYS CB C 13 35.191 0.1 . 9 . . . . 30 LYS CB . 19247 2
45 . 1 1 32 32 LYS N N 15 123.160 0.2 . 9 . . . . 30 LYS N . 19247 2
46 . 1 1 59 59 MET H H 1 8.213 0.01 . 9 . . . . 57 MET H . 19247 2
47 . 1 1 59 59 MET CA C 13 56.750 0.1 . 9 . . . . 57 MET CA . 19247 2
48 . 1 1 59 59 MET CB C 13 33.548 0.1 . 9 . . . . 57 MET CB . 19247 2
49 . 1 1 59 59 MET N N 15 122.813 0.2 . 9 . . . . 57 MET N . 19247 2
50 . 1 1 71 71 THR H H 1 8.373 0.01 . 9 . . . . 69 THR H . 19247 2
51 . 1 1 71 71 THR CA C 13 59.381 0.1 . 9 . . . . 69 THR CA . 19247 2
52 . 1 1 71 71 THR CB C 13 73.687 0.1 . 9 . . . . 69 THR CB . 19247 2
53 . 1 1 71 71 THR N N 15 110.943 0.2 . 9 . . . . 69 THR N . 19247 2
54 . 1 1 72 72 PHE H H 1 8.661 0.01 . 9 . . . . 70 PHE H . 19247 2
55 . 1 1 72 72 PHE CA C 13 57.872 0.1 . 9 . . . . 70 PHE CA . 19247 2
56 . 1 1 72 72 PHE CB C 13 43.784 0.1 . 9 . . . . 70 PHE CB . 19247 2
57 . 1 1 72 72 PHE N N 15 121.041 0.2 . 9 . . . . 70 PHE N . 19247 2
58 . 1 1 73 73 GLU H H 1 7.789 0.01 . 9 . . . . 71 GLU H . 19247 2
59 . 1 1 73 73 GLU CA C 13 54.006 0.1 . 9 . . . . 71 GLU CA . 19247 2
60 . 1 1 73 73 GLU CB C 13 32.746 0.1 . 9 . . . . 71 GLU CB . 19247 2
61 . 1 1 73 73 GLU N N 15 126.573 0.2 . 9 . . . . 71 GLU N . 19247 2
62 . 1 1 74 74 VAL H H 1 8.568 0.01 . 9 . . . . 72 VAL H . 19247 2
63 . 1 1 74 74 VAL CA C 13 60.214 0.1 . 9 . . . . 72 VAL CA . 19247 2
64 . 1 1 74 74 VAL CB C 13 35.526 0.1 . 9 . . . . 72 VAL CB . 19247 2
65 . 1 1 74 74 VAL N N 15 120.459 0.2 . 9 . . . . 72 VAL N . 19247 2
66 . 1 1 76 76 LEU H H 1 7.556 0.01 . 9 . . . . 74 LEU H . 19247 2
67 . 1 1 76 76 LEU CA C 13 53.358 0.1 . 9 . . . . 74 LEU CA . 19247 2
68 . 1 1 76 76 LEU CB C 13 43.487 0.1 . 9 . . . . 74 LEU CB . 19247 2
69 . 1 1 76 76 LEU N N 15 120.616 0.2 . 9 . . . . 74 LEU N . 19247 2
70 . 1 1 80 80 GLY H H 1 8.745 0.01 . 9 . . . . 78 GLY H . 19247 2
71 . 1 1 80 80 GLY CA C 13 43.699 0.1 . 9 . . . . 78 GLY CA . 19247 2
72 . 1 1 80 80 GLY N N 15 108.538 0.2 . 9 . . . . 78 GLY N . 19247 2
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