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 19734
_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
;
Chemical shifts list for the ssDNA in fd bacteriophage
The chemical shifts values are averaged over the entire bacteriophage genome and
therefore are not nucleotide specific (ambiguity code 5).
Two chemical shifts were identified for phosphorus (31P) in dT nucleotide. These
values are shown in ID 40 and ID 41.
;
_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 DARR . . . 19734 1
3 DARR . . . 19734 1
4 CORD . . . 19734 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 $SPARKY . . 19734 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_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 C1' C 13 85.6 0.4 . 5 . . . . 1 DA C1' . 19734 1
2 . 1 1 1 1 DA C2 C 13 154.6 0.4 . 5 . . . . 1 DA C2 . 19734 1
3 . 1 1 1 1 DA C2' C 13 40.0 0.4 . 5 . . . . 1 DA C2' . 19734 1
4 . 1 1 1 1 DA C3' C 13 80.0 0.4 . 5 . . . . 1 DA C3' . 19734 1
5 . 1 1 1 1 DA C4 C 13 150.6 0.4 . 5 . . . . 1 DA C4 . 19734 1
6 . 1 1 1 1 DA C4' C 13 87.4 0.4 . 5 . . . . 1 DA C4' . 19734 1
7 . 1 1 1 1 DA C5 C 13 119.8 0.4 . 5 . . . . 1 DA C5 . 19734 1
8 . 1 1 1 1 DA C5' C 13 68.2 0.4 . 5 . . . . 1 DA C5' . 19734 1
9 . 1 1 1 1 DA C6 C 13 157.0 0.4 . 5 . . . . 1 DA C6 . 19734 1
10 . 1 1 1 1 DA C8 C 13 141.2 0.4 . 5 . . . . 1 DA C8 . 19734 1
11 . 1 1 10 10 DC C1' C 13 86.6 2.0 . 5 . . . . 10 DC C1' . 19734 1
12 . 1 1 10 10 DC C2 C 13 159.2 0.4 . 5 . . . . 10 DC C2 . 19734 1
13 . 1 1 10 10 DC C2' C 13 40.3 0.4 . 5 . . . . 10 DC C2' . 19734 1
14 . 1 1 10 10 DC C3' C 13 80.3 0.4 . 5 . . . . 10 DC C3' . 19734 1
15 . 1 1 10 10 DC C4 C 13 168.0 0.4 . 5 . . . . 10 DC C4 . 19734 1
16 . 1 1 10 10 DC C4' C 13 86.6 2.0 . 5 . . . . 10 DC C4' . 19734 1
17 . 1 1 10 10 DC C5 C 13 99.2 0.4 . 5 . . . . 10 DC C5 . 19734 1
18 . 1 1 10 10 DC C5' C 13 68.1 0.4 . 5 . . . . 10 DC C5' . 19734 1
19 . 1 1 10 10 DC C6 C 13 142.2 0.4 . 5 . . . . 10 DC C6 . 19734 1
20 . 1 1 5 5 DG C1' C 13 85.6 0.4 . 5 . . . . 5 DG C1' . 19734 1
21 . 1 1 5 5 DG C2 C 13 156.5 0.4 . 5 . . . . 5 DG C2 . 19734 1
22 . 1 1 5 5 DG C2' C 13 38.9 0.4 . 5 . . . . 5 DG C2' . 19734 1
23 . 1 1 5 5 DG C3' C 13 80.6 0.4 . 5 . . . . 5 DG C3' . 19734 1
24 . 1 1 5 5 DG C4 C 13 154.0 0.4 . 5 . . . . 5 DG C4 . 19734 1
25 . 1 1 5 5 DG C4' C 13 87.4 0.4 . 5 . . . . 5 DG C4' . 19734 1
26 . 1 1 5 5 DG C5 C 13 117.6 0.4 . 5 . . . . 5 DG C5 . 19734 1
27 . 1 1 5 5 DG C5' C 13 68.1 0.4 . 5 . . . . 5 DG C5' . 19734 1
28 . 1 1 5 5 DG C6 C 13 161.0 0.4 . 5 . . . . 5 DG C6 . 19734 1
29 . 1 1 5 5 DG C8 C 13 138.6 0.4 . 5 . . . . 5 DG C8 . 19734 1
30 . 1 1 3 3 DT C1' C 13 85.7 0.5 . 5 . . . . 3 DT C1' . 19734 1
31 . 1 1 3 3 DT C2 C 13 153.4 0.4 . 5 . . . . 3 DT C2 . 19734 1
32 . 1 1 3 3 DT C2' C 13 39.3 0.4 . 5 . . . . 3 DT C2' . 19734 1
33 . 1 1 3 3 DT C3' C 13 80.1 0.4 . 5 . . . . 3 DT C3' . 19734 1
34 . 1 1 3 3 DT C4 C 13 168.5 0.4 . 5 . . . . 3 DT C4 . 19734 1
35 . 1 1 3 3 DT C4' C 13 86.8 0.5 . 5 . . . . 3 DT C4' . 19734 1
36 . 1 1 3 3 DT C5 C 13 113.6 0.4 . 5 . . . . 3 DT C5 . 19734 1
37 . 1 1 3 3 DT C5' C 13 68.0 0.4 . 5 . . . . 3 DT C5' . 19734 1
38 . 1 1 3 3 DT C6 C 13 139.2 0.4 . 5 . . . . 3 DT C6 . 19734 1
39 . 1 1 3 3 DT C7 C 13 14.4 0.4 . 5 . . . . 3 DT C7 . 19734 1
40 . 1 1 3 3 DT P P 31 -0.8 0.4 . 5 . . . . 3 DT P . 19734 1
41 . 1 1 6 6 DT P P 31 -1.8 0.4 . 5 . . . . 6 DT P . 19734 1
42 . 1 1 10 10 DC P P 31 -1.3 0.4 . 5 . . . . 10 DC P . 19734 1
43 . 1 1 5 5 DG P P 31 -1.8 0.4 . 5 . . . . 5 DG P . 19734 1
44 . 1 1 1 1 DA P P 31 -1.8 0.4 . 5 . . . . 1 DA P . 19734 1
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