Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 15033
_Assigned_chem_shift_list.ID 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 $chemical_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
;
This oligonucleotide adopts an unusual structural, so some chemical shifts
deviate significantly from standard values.
;
_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' . . . 15033 1
2 '2D DQF-COSY' . . . 15033 1
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 . 1 1 1 1 DC H5 H 1 6.11 0.01 . 1 . . . . 1 C H5 . 15033 1
2 . 1 1 1 1 DC H6 H 1 8.05 0.01 . 1 . . . . 1 C H6 . 15033 1
3 . 1 1 1 1 DC H1' H 1 6.48 0.01 . 1 . . . . 1 C H1' . 15033 1
4 . 1 1 1 1 DC H2' H 1 2.26 0.01 . 1 . . . . 1 C H2' . 15033 1
5 . 1 1 1 1 DC H3' H 1 4.62 0.01 . 1 . . . . 1 C H3' . 15033 1
6 . 1 1 1 1 DC H4' H 1 4.62 0.01 . 1 . . . . 1 C H4' . 15033 1
7 . 1 1 1 1 DC H5' H 1 4.01 0.01 . 2 . . . . 1 C H5' . 15033 1
8 . 1 1 1 1 DC H2'' H 1 2.64 0.01 . 1 . . . . 1 C H2'' . 15033 1
9 . 1 1 1 1 DC H5'' H 1 4.23 0.01 . 2 . . . . 1 C H5'' . 15033 1
10 . 1 1 1 1 DC C1' C 13 79.90 0.01 . 1 . . . . 1 C C1' . 15033 1
11 . 1 1 1 1 DC C2' C 13 32.62 0.01 . 1 . . . . 1 C C2' . 15033 1
12 . 1 1 1 1 DC C3' C 13 70.48 0.01 . 1 . . . . 1 C C3' . 15033 1
13 . 1 1 1 1 DC C4' C 13 78.00 0.01 . 1 . . . . 1 C C4' . 15033 1
14 . 1 1 1 1 DC C5' C 13 59.30 0.01 . 1 . . . . 1 C C5' . 15033 1
15 . 1 1 1 1 DC P P 31 -4.13 0.01 . 1 . . . . 1 C P . 15033 1
16 . 1 1 2 2 DC H5 H 1 6.01 0.01 . 1 . . . . 2 C H5 . 15033 1
17 . 1 1 2 2 DC H6 H 1 7.82 0.01 . 1 . . . . 2 C H6 . 15033 1
18 . 1 1 2 2 DC H41 H 1 9.04 0.01 . 1 . . . . 2 C H41 . 15033 1
19 . 1 1 2 2 DC H42 H 1 7.01 0.01 . 1 . . . . 2 C H42 . 15033 1
20 . 1 1 2 2 DC H1' H 1 6.34 0.01 . 1 . . . . 2 C H1' . 15033 1
21 . 1 1 2 2 DC H2' H 1 2.34 0.01 . 1 . . . . 2 C H2' . 15033 1
22 . 1 1 2 2 DC H3' H 1 4.96 0.01 . 1 . . . . 2 C H3' . 15033 1
23 . 1 1 2 2 DC H4' H 1 4.44 0.01 . 1 . . . . 2 C H4' . 15033 1
24 . 1 1 2 2 DC H5' H 1 4.09 0.01 . 1 . . . . 2 C H5' . 15033 1
25 . 1 1 2 2 DC H2'' H 1 2.81 0.01 . 1 . . . . 2 C H2'' . 15033 1
26 . 1 1 2 2 DC H5'' H 1 4.21 0.01 . 1 . . . . 2 C H5'' . 15033 1
27 . 1 1 2 2 DC C1' C 13 77.90 0.01 . 1 . . . . 2 C C1' . 15033 1
28 . 1 1 2 2 DC C2' C 13 30.62 0.01 . 1 . . . . 2 C C2' . 15033 1
29 . 1 1 2 2 DC C3' C 13 71.94 0.01 . 1 . . . . 2 C C3' . 15033 1
30 . 1 1 2 2 DC C4' C 13 77.80 0.01 . 1 . . . . 2 C C4' . 15033 1
31 . 1 1 2 2 DC C5' C 13 60.10 0.01 . 1 . . . . 2 C C5' . 15033 1
32 . 1 1 2 2 DC P P 31 -4.27 0.01 . 1 . . . . 2 C P . 15033 1
33 . 1 1 3 3 DG H1 H 1 13.76 0.01 . 1 . . . . 3 G H1 . 15033 1
34 . 1 1 3 3 DG H8 H 1 7.86 0.01 . 1 . . . . 3 G H8 . 15033 1
35 . 1 1 3 3 DG H21 H 1 9.36 0.01 . 1 . . . . 3 G H21 . 15033 1
36 . 1 1 3 3 DG H22 H 1 8.01 0.01 . 1 . . . . 3 G H22 . 15033 1
37 . 1 1 3 3 DG H1' H 1 6.11 0.01 . 1 . . . . 3 G H1' . 15033 1
38 . 1 1 3 3 DG H2' H 1 2.71 0.01 . 1 . . . . 3 G H2' . 15033 1
39 . 1 1 3 3 DG H3' H 1 5.13 0.01 . 1 . . . . 3 G H3' . 15033 1
40 . 1 1 3 3 DG H4' H 1 4.51 0.01 . 1 . . . . 3 G H4' . 15033 1
41 . 1 1 3 3 DG H5' H 1 4.25 0.01 . 1 . . . . 3 G H5' . 15033 1
42 . 1 1 3 3 DG H2'' H 1 2.55 0.01 . 1 . . . . 3 G H2'' . 15033 1
43 . 1 1 3 3 DG H5'' H 1 4.25 0.01 . 1 . . . . 3 G H5'' . 15033 1
44 . 1 1 3 3 DG C1' C 13 74.9 0.01 . 1 . . . . 3 G C1' . 15033 1
45 . 1 1 3 3 DG C2' C 13 33.12 0.01 . 1 . . . . 3 G C2' . 15033 1
46 . 1 1 3 3 DG C3' C 13 67.72 0.01 . 1 . . . . 3 G C3' . 15033 1
47 . 1 1 3 3 DG C4' C 13 77.60 0.01 . 1 . . . . 3 G C4' . 15033 1
48 . 1 1 3 3 DG C5' C 13 58.50 0.01 . 1 . . . . 3 G C5' . 15033 1
49 . 1 1 3 3 DG P P 31 -3.98 0.01 . 1 . . . . 3 G P . 15033 1
50 . 1 1 4 4 DT H3 H 1 10.51 0.01 . 1 . . . . 4 T H3 . 15033 1
51 . 1 1 4 4 DT H6 H 1 7.58 0.01 . 1 . . . . 4 T H6 . 15033 1
52 . 1 1 4 4 DT H71 H 1 1.70 0.01 . 1 . . . . 4 T H7 . 15033 1
53 . 1 1 4 4 DT H72 H 1 1.70 0.01 . 1 . . . . 4 T H7 . 15033 1
54 . 1 1 4 4 DT H73 H 1 1.70 0.01 . 1 . . . . 4 T H7 . 15033 1
55 . 1 1 4 4 DT H1' H 1 6.01 0.01 . 1 . . . . 4 T H1' . 15033 1
56 . 1 1 4 4 DT H2' H 1 1.95 0.01 . 1 . . . . 4 T H2' . 15033 1
57 . 1 1 4 4 DT H3' H 1 4.73 0.01 . 1 . . . . 4 T H3' . 15033 1
58 . 1 1 4 4 DT H4' H 1 3.84 0.01 . 1 . . . . 4 T H4' . 15033 1
59 . 1 1 4 4 DT H5' H 1 3.84 0.01 . 2 . . . . 4 T H5' . 15033 1
60 . 1 1 4 4 DT H2'' H 1 2.47 0.01 . 1 . . . . 4 T H2'' . 15033 1
61 . 1 1 4 4 DT H5'' H 1 3.80 0.01 . 2 . . . . 4 T H5'' . 15033 1
62 . 1 1 4 4 DT C1' C 13 80.60 0.01 . 1 . . . . 4 T C1' . 15033 1
63 . 1 1 4 4 DT C2' C 13 34.38 0.01 . 1 . . . . 4 T C2' . 15033 1
64 . 1 1 4 4 DT C3' C 13 71.58 0.01 . 1 . . . . 4 T C3' . 15033 1
65 . 1 1 4 4 DT C4' C 13 78.8 0.01 . 1 . . . . 4 T C4' . 15033 1
66 . 1 1 4 4 DT C5' C 13 59.4 0.01 . 1 . . . . 4 T C5' . 15033 1
67 . 1 1 4 4 DT P P 31 -3.83 0.01 . 1 . . . . 4 T P . 15033 1
stop_
save_