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 35011
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_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 NOESY' . . . 35011 1
2 '2D HOESY' . . . 35011 1
3 '2D TOCSY' . . . 35011 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 . 3 . 2 1 1 DT H1' H 1 6.338 0.00 . 1 . . . . C 1 DT H1' . 35011 1
2 . 3 . 2 1 1 DT H2' H 1 2.640 0.00 . . . . . . C 1 DT H2' . 35011 1
3 . 3 . 2 1 1 DT H2'' H 1 2.179 0.00 . . . . . . C 1 DT H2'' . 35011 1
4 . 3 . 2 1 1 DT H3 H 1 11.468 0.00 . 1 . . . . C 1 DT H3 . 35011 1
5 . 3 . 2 1 1 DT H3' H 1 4.840 0.00 . 1 . . . . C 1 DT H3' . 35011 1
6 . 3 . 2 1 1 DT H4' H 1 4.034 0.00 . 1 . . . . C 1 DT H4' . 35011 1
7 . 3 . 2 1 1 DT H5' H 1 3.864 0.00 . . . . . . C 1 DT H5' . 35011 1
8 . 3 . 2 1 1 DT H5'' H 1 3.959 0.01 . . . . . . C 1 DT H5'' . 35011 1
9 . 3 . 2 1 1 DT H6 H 1 7.647 0.00 . 1 . . . . C 1 DT H6 . 35011 1
10 . 3 . 2 1 1 DT H71 H 1 1.772 0.00 . 1 . . . . C 1 DT H71 . 35011 1
11 . 3 . 2 2 2 DNR H1' H 1 6.484 0.00 . . . . . . C 2 DNR H1' . 35011 1
12 . 3 . 2 2 2 DNR H2' H 1 2.084 0.00 . . . . . . C 2 DNR H2' . 35011 1
13 . 3 . 2 2 2 DNR H3' H 1 4.853 0.00 . . . . . . C 2 DNR H3' . 35011 1
14 . 3 . 2 2 2 DNR H4' H 1 4.170 0.00 . . . . . . C 2 DNR H4' . 35011 1
15 . 3 . 2 2 2 DNR H5 H 1 5.944 0.00 . . . . . . C 2 DNR H5 . 35011 1
16 . 3 . 2 2 2 DNR H6 H 1 7.918 0.00 . . . . . . C 2 DNR H6 . 35011 1
17 . 3 . 2 2 2 DNR H41 H 1 9.268 0.00 . . . . . . C 2 DNR H41 . 35011 1
18 . 3 . 2 2 2 DNR H42 H 1 8.254 0.00 . . . . . . C 2 DNR H42 . 35011 1
19 . 3 . 2 2 2 DNR HN3 H 1 15.865 0.00 . 1 . . . . C 2 DNR HN3 . 35011 1
20 . 3 . 2 3 3 DNR H1' H 1 6.384 0.01 . . . . . . C 3 DNR H1' . 35011 1
21 . 3 . 2 3 3 DNR H2' H 1 2.017 0.00 . . . . . . C 3 DNR H2' . 35011 1
22 . 3 . 2 3 3 DNR H3' H 1 4.822 0.00 . . . . . . C 3 DNR H3' . 35011 1
23 . 3 . 2 3 3 DNR H4' H 1 4.104 0.01 . . . . . . C 3 DNR H4' . 35011 1
24 . 3 . 2 3 3 DNR H5 H 1 5.959 0.00 . . . . . . C 3 DNR H5 . 35011 1
25 . 3 . 2 3 3 DNR H6 H 1 7.678 0.00 . . . . . . C 3 DNR H6 . 35011 1
26 . 3 . 2 3 3 DNR H41 H 1 9.242 0.00 . . . . . . C 3 DNR H41 . 35011 1
27 . 3 . 2 3 3 DNR H42 H 1 8.208 0.00 . . . . . . C 3 DNR H42 . 35011 1
28 . 3 . 2 3 3 DNR HN3 H 1 15.582 0.00 . 1 . . . . C 3 DNR HN3 . 35011 1
29 . 3 . 2 4 4 CFZ H1' H 1 6.518 0.00 . 1 . . . . C 4 CFZ H1' . 35011 1
30 . 3 . 2 4 4 CFZ H2' H 1 4.934 0.00 . 1 . . . . C 4 CFZ H2' . 35011 1
31 . 3 . 2 4 4 CFZ H3' H 1 4.631 0.00 . 1 . . . . C 4 CFZ H3' . 35011 1
32 . 3 . 2 4 4 CFZ H4' H 1 4.334 0.00 . 1 . . . . C 4 CFZ H4' . 35011 1
33 . 3 . 2 4 4 CFZ H5 H 1 5.962 0.00 . 1 . . . . C 4 CFZ H5 . 35011 1
34 . 3 . 2 4 4 CFZ H5'A H 1 4.459 0.00 . . . . . . C 4 CFZ H5'A . 35011 1
35 . 3 . 2 4 4 CFZ H6 H 1 7.498 0.00 . 1 . . . . C 4 CFZ H6 . 35011 1
36 . 3 . 2 4 4 CFZ F2' F 19 -115.124 0.00 . . . . . . C 4 CFZ F2' . 35011 1
37 . 3 . 2 4 4 CFZ HN3 H 1 15.288 0.00 . . . . . . C 4 CFZ HN3 . 35011 1
38 . 3 . 2 4 4 CFZ HN4 H 1 9.087 0.00 . . . . . . C 4 CFZ HN4 . 35011 1
39 . 3 . 2 4 4 CFZ HN4A H 1 8.639 0.00 . . . . . . C 4 CFZ HN4A . 35011 1
40 . 3 . 2 5 5 DC H1' H 1 6.350 0.00 . . . . . . C 5 DC H1' . 35011 1
41 . 3 . 2 5 5 DC H2' H 1 2.163 0.00 . . . . . . C 5 DC H2' . 35011 1
42 . 3 . 2 5 5 DC H3' H 1 4.650 0.00 . . . . . . C 5 DC H3' . 35011 1
43 . 3 . 2 5 5 DC H4' H 1 4.045 0.00 . . . . . . C 5 DC H4' . 35011 1
44 . 3 . 2 5 5 DC H5 H 1 5.923 0.00 . . . . . . C 5 DC H5 . 35011 1
45 . 3 . 2 5 5 DC H6 H 1 7.612 0.00 . . . . . . C 5 DC H6 . 35011 1
46 . 3 . 2 5 5 DC H41 H 1 9.316 0.00 . . . . . . C 5 DC H41 . 35011 1
47 . 3 . 2 5 5 DC H42 H 1 8.370 0.00 . . . . . . C 5 DC H42 . 35011 1
48 . 3 . 2 5 5 DC HN3 H 1 15.656 0.00 . 1 . . . . C 5 DC HN3 . 35011 1
49 . 3 . 2 6 6 DNR H1' H 1 6.192 0.00 . . . . . . C 6 DNR H1' . 35011 1
50 . 3 . 2 6 6 DNR H2' H 1 2.202 0.01 . . . . . . C 6 DNR H2' . 35011 1
51 . 3 . 2 6 6 DNR H3' H 1 4.301 0.00 . . . . . . C 6 DNR H3' . 35011 1
52 . 3 . 2 6 6 DNR H4' H 1 3.948 0.00 . . . . . . C 6 DNR H4' . 35011 1
53 . 3 . 2 6 6 DNR H5 H 1 5.972 0.00 . . . . . . C 6 DNR H5 . 35011 1
54 . 3 . 2 6 6 DNR H5' H 1 4.215 0.00 . . . . . . C 6 DNR H5' . 35011 1
55 . 3 . 2 6 6 DNR H5'' H 1 4.032 0.00 . . . . . . C 6 DNR H5'' . 35011 1
56 . 3 . 2 6 6 DNR H6 H 1 7.740 0.00 . . . . . . C 6 DNR H6 . 35011 1
57 . 3 . 2 6 6 DNR H41 H 1 9.197 0.00 . . . . . . C 6 DNR H41 . 35011 1
58 . 3 . 2 6 6 DNR H42 H 1 8.307 0.00 . . . . . . C 6 DNR H42 . 35011 1
59 . 3 . 2 6 6 DNR HN3 H 1 15.655 0.00 . 1 . . . . C 6 DNR HN3 . 35011 1
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