Content for NMR-STAR saveframe, "Assigned_chem_shifts"
save_Assigned_chem_shifts
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode Assigned_chem_shifts
_Assigned_chem_shift_list.Entry_ID 17535
_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 .
_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-13C HSQC' . . . 17535 1
3 '2D 1H-1H TOCSY' . . . 17535 1
5 '2D 1H-1H NOESY' . . . 17535 1
6 '2D 1H-31P CORR' . . . 17535 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 DA H1' H 1 6.259 0.002 34 . . . . . 1 A H1' . 17535 1
2 . 1 1 1 1 DA H2 H 1 8.039 0.002 14 1 . . . . 1 A H2 . 17535 1
3 . 1 1 1 1 DA H2' H 1 2.726 0.006 20 . . . . . 1 A H2' . 17535 1
4 . 1 1 1 1 DA H2'' H 1 2.843 0.003 20 2 . . . . 1 A H2'' . 17535 1
5 . 1 1 1 1 DA H3' H 1 4.874 0.002 32 . . . . . 1 A H3' . 17535 1
6 . 1 1 1 1 DA H4' H 1 4.277 0.001 16 . . . . . 1 A H4' . 17535 1
7 . 1 1 1 1 DA H8 H 1 8.245 0.001 32 1 . . . . 1 A H8 . 17535 1
8 . 1 1 1 1 DA C1' C 13 87.8 . . . . . . . 1 A C1' . 17535 1
9 . 1 1 1 1 DA C8 C 13 142.4 . . 1 . . . . 1 A C8 . 17535 1
10 . 1 1 2 2 DT H1' H 1 6.087 0.002 32 . . . . . 2 T H1' . 17535 1
11 . 1 1 2 2 DT H2' H 1 2.400 0.002 20 . . . . . 2 T H2' . 17535 1
12 . 1 1 2 2 DT H2'' H 1 2.631 0.002 16 2 . . . . 2 T H2'' . 17535 1
13 . 1 1 2 2 DT H3 H 1 13.766 . . 1 . . . . 2 T H3 . 17535 1
14 . 1 1 2 2 DT H3' H 1 4.928 0.002 24 . . . . . 2 T H3' . 17535 1
15 . 1 1 2 2 DT H4' H 1 4.334 0.002 12 . . . . . 2 T H4' . 17535 1
16 . 1 1 2 2 DT H6 H 1 7.489 0.003 56 1 . . . . 2 T H6 . 17535 1
17 . 1 1 2 2 DT H71 H 1 1.489 0.001 44 1 . . . . 2 T H7 . 17535 1
18 . 1 1 2 2 DT H72 H 1 1.489 0.001 44 1 . . . . 2 T H7 . 17535 1
19 . 1 1 2 2 DT H73 H 1 1.489 0.001 44 1 . . . . 2 T H7 . 17535 1
20 . 1 1 2 2 DT C1' C 13 86.2 . . . . . . . 2 T C1' . 17535 1
21 . 1 1 2 2 DT C6 C 13 138.8 . . 1 . . . . 2 T C6 . 17535 1
22 . 1 1 2 2 DT P P 31 -0.513 . . 1 . . . . 2 T P . 17535 1
23 . 1 1 3 3 DG H1 H 1 12.334 . . 1 . . . . 3 G H1 . 17535 1
24 . 1 1 3 3 DG H1' H 1 5.989 0.002 20 . . . . . 3 G H1' . 17535 1
25 . 1 1 3 3 DG H2' H 1 2.717 0.001 30 . . . . . 3 G H2' . 17535 1
26 . 1 1 3 3 DG H2'' H 1 2.717 0.001 30 2 . . . . 3 G H2'' . 17535 1
27 . 1 1 3 3 DG H3' H 1 4.878 0.002 20 . . . . . 3 G H3' . 17535 1
28 . 1 1 3 3 DG H4' H 1 4.409 0.001 16 . . . . . 3 G H4' . 17535 1
29 . 1 1 3 3 DG H8 H 1 7.758 0.003 44 1 . . . . 3 G H8 . 17535 1
30 . 1 1 3 3 DG C1' C 13 85.1 . . . . . . . 3 G C1' . 17535 1
31 . 1 1 3 3 DG C8 C 13 137.7 . . 1 . . . . 3 G C8 . 17535 1
32 . 1 1 3 3 DG P P 31 -0.292 . . 1 . . . . 3 G P . 17535 1
33 . 1 1 4 4 DG H1 H 1 13.078 . . 1 . . . . 4 G H1 . 17535 1
34 . 1 1 4 4 DG H1' H 1 6.010 0.002 28 . . . . . 4 G H1' . 17535 1
35 . 1 1 4 4 DG H2' H 1 2.536 0.002 20 . . . . . 4 G H2' . 17535 1
36 . 1 1 4 4 DG H2'' H 1 2.727 0.002 20 2 . . . . 4 G H2'' . 17535 1
37 . 1 1 4 4 DG H3' H 1 4.711 0.001 28 . . . . . 4 G H3' . 17535 1
38 . 1 1 4 4 DG H4' H 1 4.374 0.002 17 . . . . . 4 G H4' . 17535 1
39 . 1 1 4 4 DG H8 H 1 7.326 0.002 52 1 . . . . 4 G H8 . 17535 1
40 . 1 1 4 4 DG C1' C 13 86.3 . . . . . . . 4 G C1' . 17535 1
41 . 1 1 4 4 DG C8 C 13 136.5 . . 1 . . . . 4 G C8 . 17535 1
42 . 1 1 4 4 DG P P 31 -0.111 . . 1 . . . . 4 G P . 17535 1
43 . 1 1 5 5 DT H1' H 1 6.002 0.002 28 . . . . . 5 T H1' . 17535 1
44 . 1 1 5 5 DT H2' H 1 2.491 0.002 16 . . . . . 5 T H2' . 17535 1
45 . 1 1 5 5 DT H2'' H 1 2.570 0.002 16 2 . . . . 5 T H2'' . 17535 1
46 . 1 1 5 5 DT H3 H 1 13.708 . . 1 . . . . 5 T H3 . 17535 1
47 . 1 1 5 5 DT H3' H 1 4.984 0.003 32 . . . . . 5 T H3' . 17535 1
48 . 1 1 5 5 DT H4' H 1 4.253 0.004 12 . . . . . 5 T H4' . 17535 1
49 . 1 1 5 5 DT H6 H 1 7.428 0.002 51 1 . . . . 5 T H6 . 17535 1
50 . 1 1 5 5 DT H71 H 1 1.265 0.001 44 1 . . . . 5 T H7 . 17535 1
51 . 1 1 5 5 DT H72 H 1 1.265 0.001 44 1 . . . . 5 T H7 . 17535 1
52 . 1 1 5 5 DT H73 H 1 1.265 0.001 44 1 . . . . 5 T H7 . 17535 1
53 . 1 1 5 5 DT C1' C 13 86.5 . . . . . . . 5 T C1' . 17535 1
54 . 1 1 5 5 DT C6 C 13 138.1 . . 1 . . . . 5 T C6 . 17535 1
55 . 1 1 5 5 DT P P 31 -0.749 . . 1 . . . . 5 T P . 17535 1
56 . 1 1 6 6 BGR BP B 11 -41.43 . . . . . . . 6 X BP . 17535 1
57 . 1 1 6 6 BGR C1' C 13 85.8 . . . . . . . 6 X C1' . 17535 1
58 . 1 1 6 6 BGR C8 C 13 137.3 . . . . . . . 6 X C8 . 17535 1
59 . 1 1 6 6 BGR H1 H 1 12.458 . . . . . . . 6 X H1 . 17535 1
60 . 1 1 6 6 BGR H1' H 1 5.984 0.002 24 . . . . . 6 X H1' . 17535 1
61 . 1 1 6 6 BGR H2' H 1 2.634 0.001 24 . . . . . 6 X H2' . 17535 1
62 . 1 1 6 6 BGR H2'' H 1 2.634 0.001 24 . . . . . 6 X H2'' . 17535 1
63 . 1 1 6 6 BGR H3' H 1 4.720 0.003 26 . . . . . 6 X H3' . 17535 1
64 . 1 1 6 6 BGR H4' H 1 4.349 0.002 14 . . . . . 6 X H4' . 17535 1
65 . 1 1 6 6 BGR H8 H 1 7.677 0.002 52 . . . . . 6 X H8 . 17535 1
66 . 1 1 6 6 BGR H1BP H 1 0.33 . . . . . . . 6 X MB . 17535 1
67 . 1 1 6 6 BGR H2BP H 1 0.33 . . . . . . . 6 X MB . 17535 1
68 . 1 1 6 6 BGR H3BP H 1 0.33 . . . . . . . 6 X MB . 17535 1
69 . 1 1 6 6 BGR P P 31 94.00 . . . . . . . 6 X P . 17535 1
70 . 1 1 7 7 DC H1' H 1 5.878 0.001 36 . . . . . 7 C H1' . 17535 1
71 . 1 1 7 7 DC H2' H 1 2.320 0.002 20 . . . . . 7 C H2' . 17535 1
72 . 1 1 7 7 DC H2'' H 1 2.579 0.004 20 2 . . . . 7 C H2'' . 17535 1
73 . 1 1 7 7 DC H3' H 1 4.600 0.002 28 . . . . . 7 C H3' . 17535 1
74 . 1 1 7 7 DC H4' H 1 4.260 0.003 15 . . . . . 7 C H4' . 17535 1
75 . 1 1 7 7 DC H5 H 1 5.146 0.002 29 1 . . . . 7 C H5 . 17535 1
76 . 1 1 7 7 DC H6 H 1 7.419 0.003 46 1 . . . . 7 C H6 . 17535 1
77 . 1 1 7 7 DC C1' C 13 87.8 . . . . . . . 7 C C1' . 17535 1
78 . 1 1 7 7 DC C6 C 13 141.8 . . 1 . . . . 7 C C6 . 17535 1
79 . 1 1 7 7 DC P P 31 -0.323 . . 1 . . . . 7 C P . 17535 1
80 . 1 1 8 8 DT H1' H 1 6.094 0.002 34 . . . . . 8 T H1' . 17535 1
81 . 1 1 8 8 DT H2' H 1 2.314 0.002 23 . . . . . 8 T H2' . 17535 1
82 . 1 1 8 8 DT H2'' H 1 2.614 0.001 19 2 . . . . 8 T H2'' . 17535 1
83 . 1 1 8 8 DT H3 H 1 14.03 . . 1 . . . . 8 T H3 . 17535 1
84 . 1 1 8 8 DT H3' H 1 4.844 0.002 26 . . . . . 8 T H3' . 17535 1
85 . 1 1 8 8 DT H4' H 1 4.228 0.001 12 . . . . . 8 T H4' . 17535 1
86 . 1 1 8 8 DT H6 H 1 7.639 0.001 50 1 . . . . 8 T H6 . 17535 1
87 . 1 1 8 8 DT H71 H 1 1.503 0.002 44 1 . . . . 8 T H7 . 17535 1
88 . 1 1 8 8 DT H72 H 1 1.503 0.002 44 1 . . . . 8 T H7 . 17535 1
89 . 1 1 8 8 DT H73 H 1 1.503 0.002 44 1 . . . . 8 T H7 . 17535 1
90 . 1 1 8 8 DT C1' C 13 86.7 . . . . . . . 8 T C1' . 17535 1
91 . 1 1 8 8 DT C6 C 13 139.4 . . 1 . . . . 8 T C6 . 17535 1
92 . 1 1 8 8 DT P P 31 -0.942 . . 1 . . . . 8 T P . 17535 1
93 . 1 1 9 9 DC H1' H 1 6.269 0.001 28 . . . . . 9 C H1' . 17535 1
94 . 1 1 9 9 DC H2' H 1 2.174 0.002 19 . . . . . 9 C H2' . 17535 1
95 . 1 1 9 9 DC H2'' H 1 2.258 0.003 16 2 . . . . 9 C H2'' . 17535 1
96 . 1 1 9 9 DC H3' H 1 4.529 0.002 19 . . . . . 9 C H3' . 17535 1
97 . 1 1 9 9 DC H4' H 1 4.044 0.001 16 . . . . . 9 C H4' . 17535 1
98 . 1 1 9 9 DC H5 H 1 5.629 0.003 32 1 . . . . 9 C H5 . 17535 1
99 . 1 1 9 9 DC H6 H 1 7.619 0.002 36 1 . . . . 9 C H6 . 17535 1
100 . 1 1 9 9 DC C1' C 13 86.7 . . . . . . . 9 C C1' . 17535 1
101 . 1 1 9 9 DC C6 C 13 143.9 . . 1 . . . . 9 C C6 . 17535 1
102 . 1 1 9 9 DC P P 31 -0.446 . . 1 . . . . 9 C P . 17535 1
103 . 2 2 1 1 G H1 H 1 12.488 . . 1 . . . B 10 G H1 . 17535 1
104 . 2 2 1 1 G H1' H 1 5.633 0.002 34 . . . . B 10 G H1' . 17535 1
105 . 2 2 1 1 G H2' H 1 4.824 0.003 18 . . . . B 10 G H2' . 17535 1
106 . 2 2 1 1 G H3' H 1 4.625 0.002 16 . . . . B 10 G H3' . 17535 1
107 . 2 2 1 1 G H4' H 1 4.342 0.001 8 . . . . B 10 G H4' . 17535 1
108 . 2 2 1 1 G H8 H 1 7.972 0.001 24 1 . . . B 10 G H8 . 17535 1
109 . 2 2 1 1 G C1' C 13 91.8 . . . . . . B 10 G C1' . 17535 1
110 . 2 2 1 1 G C8 C 13 138.8 . . 1 . . . B 10 G C8 . 17535 1
111 . 2 2 2 2 A H1' H 1 6.038 0.002 26 . . . . B 11 A H1' . 17535 1
112 . 2 2 2 2 A H2 H 1 7.735 0.002 14 1 . . . B 11 A H2 . 17535 1
113 . 2 2 2 2 A H2' H 1 4.814 0.001 16 . . . . B 11 A H2' . 17535 1
114 . 2 2 2 2 A H3' H 1 4.748 0.003 12 . . . . B 11 A H3' . 17535 1
115 . 2 2 2 2 A H4' H 1 4.552 0.001 4 . . . . B 11 A H4' . 17535 1
116 . 2 2 2 2 A H8 H 1 8.065 0.001 36 1 . . . B 11 A H8 . 17535 1
117 . 2 2 2 2 A C1' C 13 92.5 . . . . . . B 11 A C1' . 17535 1
118 . 2 2 2 2 A C8 C 13 140 . . 1 . . . B 11 A C8 . 17535 1
119 . 2 2 2 2 A P P 31 -0.119 . . 1 . . . B 11 A P . 17535 1
120 . 2 2 3 3 G H1 H 1 13.294 . . 1 . . . B 12 G H1 . 17535 1
121 . 2 2 3 3 G H1' H 1 5.581 0.001 36 . . . . B 12 G H1' . 17535 1
122 . 2 2 3 3 G H2' H 1 4.449 0.005 24 . . . . B 12 G H2' . 17535 1
123 . 2 2 3 3 G H3' H 1 4.415 0.003 12 . . . . B 12 G H3' . 17535 1
124 . 2 2 3 3 G H4' H 1 4.485 0.003 8 . . . . B 12 G H4' . 17535 1
125 . 2 2 3 3 G H8 H 1 7.282 0.002 44 1 . . . B 12 G H8 . 17535 1
126 . 2 2 3 3 G C1' C 13 92.7 . . . . . . B 12 G C1' . 17535 1
127 . 2 2 3 3 G C8 C 13 135.8 . . 1 . . . B 12 G C8 . 17535 1
128 . 2 2 3 3 G P P 31 -0.23 . . 1 . . . B 12 G P . 17535 1
129 . 2 2 4 4 C H1' H 1 5.420 0.001 32 . . . . B 13 C H1' . 17535 1
130 . 2 2 4 4 C H2' H 1 4.518 0.002 20 . . . . B 13 C H2' . 17535 1
131 . 2 2 4 4 C H3' H 1 4.495 0.001 16 . . . . B 13 C H3' . 17535 1
132 . 2 2 4 4 C H4' H 1 4.417 0.000 8 . . . . B 13 C H4' . 17535 1
133 . 2 2 4 4 C H5 H 1 5.218 0.004 28 1 . . . B 13 C H5 . 17535 1
134 . 2 2 4 4 C H6 H 1 7.602 0.004 40 1 . . . B 13 C H6 . 17535 1
135 . 2 2 4 4 C C1' C 13 93.7 . . . . . . B 13 C C1' . 17535 1
136 . 2 2 4 4 C C6 C 13 140.5 . . 1 . . . B 13 C C6 . 17535 1
137 . 2 2 4 4 C P P 31 -0.71 . . 1 . . . B 13 C P . 17535 1
138 . 2 2 5 5 A H1' H 1 5.920 0.001 42 . . . . B 14 A H1' . 17535 1
139 . 2 2 5 5 A H2 H 1 7.433 0.003 16 1 . . . B 14 A H2 . 17535 1
140 . 2 2 5 5 A H2' H 1 4.564 0.002 20 . . . . B 14 A H2' . 17535 1
141 . 2 2 5 5 A H3' H 1 4.664 0.001 16 . . . . B 14 A H3' . 17535 1
142 . 2 2 5 5 A H4' H 1 4.480 0.004 4 . . . . B 14 A H4' . 17535 1
143 . 2 2 5 5 A H8 H 1 8.073 0.001 40 1 . . . B 14 A H8 . 17535 1
144 . 2 2 5 5 A C1' C 13 92.9 . . . . . . B 14 A C1' . 17535 1
145 . 2 2 5 5 A C8 C 13 139.3 . . 1 . . . B 14 A C8 . 17535 1
146 . 2 2 5 5 A P P 31 -0.377 . . 1 . . . B 14 A P . 17535 1
147 . 2 2 6 6 C H1' H 1 5.339 0.002 32 . . . . B 15 C H1' . 17535 1
148 . 2 2 6 6 C H2' H 1 4.265 0.002 16 . . . . B 15 C H2' . 17535 1
149 . 2 2 6 6 C H3' H 1 4.341 0.006 19 . . . . B 15 C H3' . 17535 1
150 . 2 2 6 6 C H4' H 1 4.564 0.002 8 . . . . B 15 C H4' . 17535 1
151 . 2 2 6 6 C H5 H 1 5.241 0.003 25 1 . . . B 15 C H5 . 17535 1
152 . 2 2 6 6 C H6 H 1 7.505 0.003 44 1 . . . B 15 C H6 . 17535 1
153 . 2 2 6 6 C C1' C 13 93.7 . . . . . . B 15 C C1' . 17535 1
154 . 2 2 6 6 C C6 C 13 140.6 . . 1 . . . B 15 C C6 . 17535 1
155 . 2 2 6 6 C P P 31 -0.613 . . 1 . . . B 15 C P . 17535 1
156 . 2 2 7 7 C H1' H 1 5.405 0.002 28 . . . . B 16 C H1' . 17535 1
157 . 2 2 7 7 C H2' H 1 4.358 0.001 14 . . . . B 16 C H2' . 17535 1
158 . 2 2 7 7 C H3' H 1 4.538 0.004 16 . . . . B 16 C H3' . 17535 1
159 . 2 2 7 7 C H4' H 1 4.262 0.002 12 . . . . B 16 C H4' . 17535 1
160 . 2 2 7 7 C H5 H 1 5.504 0.002 30 1 . . . B 16 C H5 . 17535 1
161 . 2 2 7 7 C H6 H 1 7.740 0.002 42 1 . . . B 16 C H6 . 17535 1
162 . 2 2 7 7 C C1' C 13 94.8 . . . . . . B 16 C C1' . 17535 1
163 . 2 2 7 7 C C6 C 13 141.1 . . 1 . . . B 16 C C6 . 17535 1
164 . 2 2 7 7 C P P 31 -0.677 . . 1 . . . B 16 C P . 17535 1
165 . 2 2 8 8 A H1' H 1 5.995 0.002 28 . . . . B 17 A H1' . 17535 1
166 . 2 2 8 8 A H2 H 1 7.625 0.001 8 1 . . . B 17 A H2 . 17535 1
167 . 2 2 8 8 A H2' H 1 4.376 0.001 26 . . . . B 17 A H2' . 17535 1
168 . 2 2 8 8 A H3' H 1 4.717 0.002 18 . . . . B 17 A H3' . 17535 1
169 . 2 2 8 8 A H4' H 1 4.468 0.003 9 . . . . B 17 A H4' . 17535 1
170 . 2 2 8 8 A H8 H 1 8.182 0.001 41 1 . . . B 17 A H8 . 17535 1
171 . 2 2 8 8 A C1' C 13 92.4 . . . . . . B 17 A C1' . 17535 1
172 . 2 2 8 8 A C8 C 13 140 . . 1 . . . B 17 A C8 . 17535 1
173 . 2 2 8 8 A P P 31 -0.503 . . 1 . . . B 17 A P . 17535 1
174 . 2 2 9 9 U H1' H 1 5.758 0.001 23 . . . . B 18 U H1' . 17535 1
175 . 2 2 9 9 U H2' H 1 4.041 0.002 8 . . . . B 18 U H2' . 17535 1
176 . 2 2 9 9 U H3 H 1 13.425 . . 1 . . . B 18 U H3 . 17535 1
177 . 2 2 9 9 U H3' H 1 4.177 0.002 12 . . . . B 18 U H3' . 17535 1
178 . 2 2 9 9 U H4' H 1 4.378 0.001 8 . . . . B 18 U H4' . 17535 1
179 . 2 2 9 9 U H5 H 1 5.352 0.004 20 1 . . . B 18 U H5 . 17535 1
180 . 2 2 9 9 U H6 H 1 7.579 0.002 34 1 . . . B 18 U H6 . 17535 1
181 . 2 2 9 9 U C1' C 13 91.6 . . . . . . B 18 U C1' . 17535 1
182 . 2 2 9 9 U C6 C 13 142.5 . . 1 . . . B 18 U C6 . 17535 1
183 . 2 2 9 9 U P P 31 -0.438 . . 1 . . . B 18 U P . 17535 1
stop_
save_