Content for NMR-STAR saveframe, assigned_chemical_shifts_1
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 52122
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name d(5mCpG)3
_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 .
_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 '2D 1H-1H NOESY' . . . 52122 1
2 '2D 1H-13C HSQC' . . . 52122 1
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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 . . 52122 1
2 $software_2 . . 52122 1
3 $software_3 . . 52122 1
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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 1 1 MCY H1' H 1 5.799 0.008 . 1 . . . . . 1 X H1' . 52122 1
2 . 1 . 1 1 1 MCY H2' H 1 2.049 0 . 1 . . . . . 1 X H2' . 52122 1
3 . 1 . 1 1 1 MCY H2'' H 1 2.419 0 . 1 . . . . . 1 X H2'' . 52122 1
4 . 1 . 1 1 1 MCY H4' H 1 4.07 0.008 . 1 . . . . . 1 X H4' . 52122 1
5 . 1 . 1 1 1 MCY H5' H 1 3.723 0.001 . 1 . . . . . 1 X H5' . 52122 1
6 . 1 . 1 1 1 MCY H5'' H 1 3.723 0.001 . 1 . . . . . 1 X H5'' . 52122 1
7 . 1 . 1 1 1 MCY H6 H 1 7.502 0.004 . 1 . . . . . 1 X H6 . 52122 1
8 . 1 . 1 1 1 MCY C1' C 13 87.754 0.043 . 1 . . . . . 1 X C1' . 52122 1
9 . 1 . 1 1 1 MCY C2' C 13 39.767 0.003 . 1 . . . . . 1 X C2' . 52122 1
10 . 1 . 1 1 1 MCY C4' C 13 88.185 0.045 . 1 . . . . . 1 X C4' . 52122 1
11 . 1 . 1 1 1 MCY C5' C 13 63.894 0 . 1 . . . . . 1 X C5' . 52122 1
12 . 1 . 1 1 1 MCY C6 C 13 140.269 0.048 . 1 . . . . . 1 X C6 . 52122 1
13 . 1 . 1 1 1 MCY C7 C 13 30.147 0 . 1 . . . . . 1 X C7 . 52122 1
14 . 1 . 1 1 1 MCY H7 H 1 1.916 0.003 . 1 . . . . . 1 X M7 . 52122 1
15 . 1 . 1 2 2 DG H1' H 1 6.031 0.002 . 1 . . . . . 2 G H1' . 52122 1
16 . 1 . 1 2 2 DG H2' H 1 2.697 0 . 1 . . . . . 2 G H2' . 52122 1
17 . 1 . 1 2 2 DG H2'' H 1 2.863 0 . 1 . . . . . 2 G H2'' . 52122 1
18 . 1 . 1 2 2 DG H3' H 1 5.007 0 . 1 . . . . . 2 G H3' . 52122 1
19 . 1 . 1 2 2 DG H4' H 1 4.391 0.002 . 1 . . . . . 2 G H4' . 52122 1
20 . 1 . 1 2 2 DG H5' H 1 4.111 0 . 1 . . . . . 2 G H5' . 52122 1
21 . 1 . 1 2 2 DG H5'' H 1 4.014 0 . 1 . . . . . 2 G H5'' . 52122 1
22 . 1 . 1 2 2 DG H8 H 1 8.013 0.003 . 1 . . . . . 2 G H8 . 52122 1
23 . 1 . 1 2 2 DG C1' C 13 84.581 0.013 . 1 . . . . . 2 G C1' . 52122 1
24 . 1 . 1 2 2 DG C2' C 13 39.933 0.002 . 1 . . . . . 2 G C2' . 52122 1
25 . 1 . 1 2 2 DG C3' C 13 79.991 0 . 1 . . . . . 2 G C3' . 52122 1
26 . 1 . 1 2 2 DG C4' C 13 87.429 0.053 . 1 . . . . . 2 G C4' . 52122 1
27 . 1 . 1 2 2 DG C5' C 13 68.452 0.002 . 1 . . . . . 2 G C5' . 52122 1
28 . 1 . 1 2 2 DG C8 C 13 138.285 0.07 . 1 . . . . . 2 G C8 . 52122 1
29 . 1 . 1 3 3 MCY H1' H 1 5.707 0.006 . 1 . . . . . 3 X H1' . 52122 1
30 . 1 . 1 3 3 MCY H2' H 1 2.089 0 . 1 . . . . . 3 X H2' . 52122 1
31 . 1 . 1 3 3 MCY H2'' H 1 2.396 0 . 1 . . . . . 3 X H2'' . 52122 1
32 . 1 . 1 3 3 MCY H3' H 1 4.866 0 . 1 . . . . . 3 X H3' . 52122 1
33 . 1 . 1 3 3 MCY H4' H 1 4.202 0.007 . 1 . . . . . 3 X H4' . 52122 1
34 . 1 . 1 3 3 MCY H5' H 1 4.193 0 . 1 . . . . . 3 X H5' . 52122 1
35 . 1 . 1 3 3 MCY H5'' H 1 4.164 0 . 1 . . . . . 3 X H5'' . 52122 1
36 . 1 . 1 3 3 MCY H6 H 1 7.195 0.003 . 1 . . . . . 3 X H6 . 52122 1
37 . 1 . 1 3 3 MCY H41 H 1 6.111 0.001 . 1 . . . . . 3 X H41 . 52122 1
38 . 1 . 1 3 3 MCY H42 H 1 8.759 0.003 . 1 . . . . . 3 X H42 . 52122 1
39 . 1 . 1 3 3 MCY C1' C 13 86.285 0.055 . 1 . . . . . 3 X C1' . 52122 1
40 . 1 . 1 3 3 MCY C2' C 13 39.693 0.005 . 1 . . . . . 3 X C2' . 52122 1
41 . 1 . 1 3 3 MCY C3' C 13 77.158 0 . 1 . . . . . 3 X C3' . 52122 1
42 . 1 . 1 3 3 MCY C4' C 13 85.419 0.014 . 1 . . . . . 3 X C4' . 52122 1
43 . 1 . 1 3 3 MCY C5' C 13 67.542 0.002 . 1 . . . . . 3 X C5' . 52122 1
44 . 1 . 1 3 3 MCY C6 C 13 139.049 0.065 . 1 . . . . . 3 X C6 . 52122 1
45 . 1 . 1 3 3 MCY C7 C 13 30.266 0 . 1 . . . . . 3 X C7 . 52122 1
46 . 1 . 1 3 3 MCY H7 H 1 1.634 0.003 . 1 . . . . . 3 X M7 . 52122 1
47 . 1 . 1 4 4 DG H1' H 1 5.981 0.003 . 1 . . . . . 4 G H1' . 52122 1
48 . 1 . 1 4 4 DG H2' H 1 2.612 0 . 1 . . . . . 4 G H2' . 52122 1
49 . 1 . 1 4 4 DG H2'' H 1 2.791 0 . 1 . . . . . 4 G H2'' . 52122 1
50 . 1 . 1 4 4 DG H3' H 1 5.009 0 . 1 . . . . . 4 G H3' . 52122 1
51 . 1 . 1 4 4 DG H4' H 1 4.39 0.003 . 1 . . . . . 4 G H4' . 52122 1
52 . 1 . 1 4 4 DG H5' H 1 4.14 0 . 1 . . . . . 4 G H5' . 52122 1
53 . 1 . 1 4 4 DG H5'' H 1 4.073 0 . 1 . . . . . 4 G H5'' . 52122 1
54 . 1 . 1 4 4 DG H8 H 1 7.93 0.002 . 1 . . . . . 4 G H8 . 52122 1
55 . 1 . 1 4 4 DG C1' C 13 84.702 0.059 . 1 . . . . . 4 G C1' . 52122 1
56 . 1 . 1 4 4 DG C2' C 13 40.321 0.006 . 1 . . . . . 4 G C2' . 52122 1
57 . 1 . 1 4 4 DG C3' C 13 79.993 0 . 1 . . . . . 4 G C3' . 52122 1
58 . 1 . 1 4 4 DG C4' C 13 87.429 0.061 . 1 . . . . . 4 G C4' . 52122 1
59 . 1 . 1 4 4 DG C5' C 13 68.534 0.001 . 1 . . . . . 4 G C5' . 52122 1
60 . 1 . 1 4 4 DG C8 C 13 138.23 0.087 . 1 . . . . . 4 G C8 . 52122 1
61 . 1 . 1 5 5 MCY H1' H 1 5.788 0.007 . 1 . . . . . 5 X H1' . 52122 1
62 . 1 . 1 5 5 MCY H2' H 1 1.897 0 . 1 . . . . . 5 X H2' . 52122 1
63 . 1 . 1 5 5 MCY H2'' H 1 2.307 0.001 . 1 . . . . . 5 X H2'' . 52122 1
64 . 1 . 1 5 5 MCY H3' H 1 4.825 0 . 1 . . . . . 5 X H3' . 52122 1
65 . 1 . 1 5 5 MCY H4' H 1 4.152 0.003 . 1 . . . . . 5 X H4' . 52122 1
66 . 1 . 1 5 5 MCY H5' H 1 4.232 0 . 1 . . . . . 5 X H5' . 52122 1
67 . 1 . 1 5 5 MCY H5'' H 1 4.128 0 . 1 . . . . . 5 X H5'' . 52122 1
68 . 1 . 1 5 5 MCY H6 H 1 7.154 0.003 . 1 . . . . . 5 X H6 . 52122 1
69 . 1 . 1 5 5 MCY H41 H 1 6.198 0.001 . 1 . . . . . 5 X H41 . 52122 1
70 . 1 . 1 5 5 MCY H42 H 1 8.78 0.002 . 1 . . . . . 5 X H42 . 52122 1
71 . 1 . 1 5 5 MCY C1' C 13 86.109 0.059 . 1 . . . . . 5 X C1' . 52122 1
72 . 1 . 1 5 5 MCY C2' C 13 39.569 0.004 . 1 . . . . . 5 X C2' . 52122 1
73 . 1 . 1 5 5 MCY C3' C 13 76.396 0 . 1 . . . . . 5 X C3' . 52122 1
74 . 1 . 1 5 5 MCY C4' C 13 85.169 0.065 . 1 . . . . . 5 X C4' . 52122 1
75 . 1 . 1 5 5 MCY C5' C 13 66.815 0.003 . 1 . . . . . 5 X C5' . 52122 1
76 . 1 . 1 5 5 MCY C6 C 13 139.196 0.058 . 1 . . . . . 5 X C6 . 52122 1
77 . 1 . 1 5 5 MCY C7 C 13 30.266 0 . 1 . . . . . 5 X C7 . 52122 1
78 . 1 . 1 5 5 MCY H7 H 1 1.679 0.003 . 1 . . . . . 5 X M7 . 52122 1
79 . 1 . 1 6 6 DG H1' H 1 6.17 0.005 . 1 . . . . . 6 G H1' . 52122 1
80 . 1 . 1 6 6 DG H2' H 1 2.384 0 . 1 . . . . . 6 G H2' . 52122 1
81 . 1 . 1 6 6 DG H2'' H 1 2.618 0 . 1 . . . . . 6 G H2'' . 52122 1
82 . 1 . 1 6 6 DG H3' H 1 4.661 0 . 1 . . . . . 6 G H3' . 52122 1
83 . 1 . 1 6 6 DG H4' H 1 4.187 0.004 . 1 . . . . . 6 G H4' . 52122 1
84 . 1 . 1 6 6 DG H5' H 1 4.102 0 . 1 . . . . . 6 G H5' . 52122 1
85 . 1 . 1 6 6 DG H5'' H 1 4.074 0 . 1 . . . . . 6 G H5'' . 52122 1
86 . 1 . 1 6 6 DG H8 H 1 7.929 0.003 . 1 . . . . . 6 G H8 . 52122 1
87 . 1 . 1 6 6 DG C1' C 13 84.832 0.06 . 1 . . . . . 6 G C1' . 52122 1
88 . 1 . 1 6 6 DG C2' C 13 41.877 0.001 . 1 . . . . . 6 G C2' . 52122 1
89 . 1 . 1 6 6 DG C3' C 13 73.337 0 . 1 . . . . . 6 G C3' . 52122 1
90 . 1 . 1 6 6 DG C4' C 13 87.933 0.042 . 1 . . . . . 6 G C4' . 52122 1
91 . 1 . 1 6 6 DG C5' C 13 67.55 0.002 . 1 . . . . . 6 G C5' . 52122 1
92 . 1 . 1 6 6 DG C8 C 13 139.26 0.037 . 1 . . . . . 6 G C8 . 52122 1
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