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 52160
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name MRE11_565_595_shifts
_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 .
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_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 '3D CBCA(CO)NH' . . . 52160 1
3 '3D HNCACB' . . . 52160 1
4 '2D 1H-13C HSQC/HMQC' . . . 52160 1
5 '3D HN(CAN)NH' . . . 52160 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 . . 52160 1
2 $software_2 . . 52160 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 THR CA C 13 61.806 0.071 . . . . . . . 566 T CA . 52160 1
2 . 1 . 1 1 1 THR CB C 13 69.678 0.064 . . . . . . . 566 T CB . 52160 1
3 . 1 . 1 1 1 THR N N 15 113.302 0.002 . . . . . . . 566 T N . 52160 1
4 . 1 . 1 2 2 ASN H H 1 8.508 0.005 . . . . . . . 567 N HN . 52160 1
5 . 1 . 1 2 2 ASN CA C 13 53.320 0.000 . . . . . . . 567 N CA . 52160 1
6 . 1 . 1 2 2 ASN CB C 13 38.643 0.000 . . . . . . . 567 N CB . 52160 1
7 . 1 . 1 2 2 ASN N N 15 121.089 0.002 . . . . . . . 567 N N . 52160 1
8 . 1 . 1 3 3 LYS H H 1 8.496 0.000 . . . . . . . 568 K HN . 52160 1
9 . 1 . 1 3 3 LYS N N 15 119.817 0.000 . . . . . . . 568 K N . 52160 1
10 . 1 . 1 10 10 GLY H H 1 8.533 0.000 . . . . . . . 575 G HN . 52160 1
11 . 1 . 1 10 10 GLY N N 15 109.946 0.000 . . . . . . . 575 G N . 52160 1
12 . 1 . 1 11 11 ARG H H 1 8.274 0.000 . . . . . . . 576 R HN . 52160 1
13 . 1 . 1 11 11 ARG N N 15 120.908 0.000 . . . . . . . 576 R N . 52160 1
14 . 1 . 1 12 12 ARG H H 1 8.520 0.000 . . . . . . . 577 R HN . 52160 1
15 . 1 . 1 12 12 ARG N N 15 122.548 0.000 . . . . . . . 577 R N . 52160 1
16 . 1 . 1 13 13 GLY H H 1 8.444 0.000 . . . . . . . 578 G HN . 52160 1
17 . 1 . 1 13 13 GLY N N 15 110.151 0.000 . . . . . . . 578 G N . 52160 1
18 . 1 . 1 14 14 GLY H H 1 8.277 0.000 . . . . . . . 579 G HN . 52160 1
19 . 1 . 1 14 14 GLY N N 15 108.761 0.000 . . . . . . . 579 G N . 52160 1
20 . 1 . 1 15 15 ARG H H 1 8.336 0.000 . . . . . . . 580 R HN . 52160 1
21 . 1 . 1 15 15 ARG N N 15 120.539 0.000 . . . . . . . 580 R N . 52160 1
22 . 1 . 1 16 16 GLY H H 1 8.532 0.000 . . . . . . . 581 G HN . 52160 1
23 . 1 . 1 16 16 GLY N N 15 110.026 0.000 . . . . . . . 581 G N . 52160 1
24 . 1 . 1 17 17 GLN CA C 13 55.483 0.003 . . . . . . . 582 Q CA . 52160 1
25 . 1 . 1 17 17 GLN CB C 13 29.693 0.097 . . . . . . . 582 Q CB . 52160 1
26 . 1 . 1 18 18 ASN H H 1 8.116 0.000 . . . . . . . 583 N HN . 52160 1
27 . 1 . 1 18 18 ASN CA C 13 54.794 0.000 . . . . . . . 583 N CA . 52160 1
28 . 1 . 1 18 18 ASN CB C 13 40.603 0.000 . . . . . . . 583 N CB . 52160 1
29 . 1 . 1 18 18 ASN N N 15 125.370 0.000 . . . . . . . 583 N N . 52160 1
30 . 1 . 1 19 19 SER H H 1 8.263 0.001 . . . . . . . 584 S HN . 52160 1
31 . 1 . 1 19 19 SER CA C 13 58.671 0.083 . . . . . . . 584 S CA . 52160 1
32 . 1 . 1 19 19 SER CB C 13 63.678 0.047 . . . . . . . 584 S CB . 52160 1
33 . 1 . 1 19 19 SER N N 15 116.569 0.001 . . . . . . . 584 S N . 52160 1
34 . 1 . 1 20 20 ALA H H 1 8.309 0.001 . . . . . . . 585 A HN . 52160 1
35 . 1 . 1 20 20 ALA CA C 13 52.704 0.034 . . . . . . . 585 A CA . 52160 1
36 . 1 . 1 20 20 ALA CB C 13 18.994 0.000 . . . . . . . 585 A CB . 52160 1
37 . 1 . 1 20 20 ALA N N 15 125.719 0.002 . . . . . . . 585 A N . 52160 1
38 . 1 . 1 21 21 SER H H 1 8.138 0.002 . . . . . . . 586 S HN . 52160 1
39 . 1 . 1 21 21 SER CA C 13 58.456 0.009 . . . . . . . 586 S CA . 52160 1
40 . 1 . 1 21 21 SER CB C 13 63.567 0.033 . . . . . . . 586 S CB . 52160 1
41 . 1 . 1 21 21 SER N N 15 114.749 0.003 . . . . . . . 586 S N . 52160 1
42 . 1 . 1 22 22 ARG H H 1 8.301 0.001 . . . . . . . 587 R HN . 52160 1
43 . 1 . 1 22 22 ARG CA C 13 56.265 0.033 . . . . . . . 587 R CA . 52160 1
44 . 1 . 1 22 22 ARG CB C 13 30.494 0.033 . . . . . . . 587 R CB . 52160 1
45 . 1 . 1 22 22 ARG N N 15 122.971 0.001 . . . . . . . 587 R N . 52160 1
46 . 1 . 1 23 23 GLY H H 1 8.358 0.001 . . . . . . . 588 G HN . 52160 1
47 . 1 . 1 23 23 GLY CA C 13 45.244 0.033 . . . . . . . 588 G CA . 52160 1
48 . 1 . 1 23 23 GLY N N 15 109.650 0.001 . . . . . . . 588 G N . 52160 1
49 . 1 . 1 24 24 GLY H H 1 8.244 0.003 . . . . . . . 589 G HN . 52160 1
50 . 1 . 1 24 24 GLY CA C 13 45.184 0.069 . . . . . . . 589 G CA . 52160 1
51 . 1 . 1 24 24 GLY N N 15 108.831 0.001 . . . . . . . 589 G N . 52160 1
52 . 1 . 1 25 25 SER H H 1 8.269 0.003 . . . . . . . 590 S HN . 52160 1
53 . 1 . 1 25 25 SER CA C 13 58.508 0.022 . . . . . . . 590 S CA . 52160 1
54 . 1 . 1 25 25 SER CB C 13 63.712 0.023 . . . . . . . 590 S CB . 52160 1
55 . 1 . 1 25 25 SER N N 15 115.701 0.002 . . . . . . . 590 S N . 52160 1
56 . 1 . 1 26 26 GLN H H 1 8.435 0.001 . . . . . . . 591 Q HN . 52160 1
57 . 1 . 1 26 26 GLN CA C 13 55.788 0.004 . . . . . . . 591 Q CA . 52160 1
58 . 1 . 1 26 26 GLN CB C 13 29.132 0.005 . . . . . . . 591 Q CB . 52160 1
59 . 1 . 1 26 26 GLN N N 15 122.121 0.001 . . . . . . . 591 Q N . 52160 1
60 . 1 . 1 27 27 ARG H H 1 8.280 0.002 . . . . . . . 592 R HN . 52160 1
61 . 1 . 1 27 27 ARG CA C 13 56.358 0.028 . . . . . . . 592 R CA . 52160 1
62 . 1 . 1 27 27 ARG CB C 13 30.550 0.033 . . . . . . . 592 R CB . 52160 1
63 . 1 . 1 27 27 ARG N N 15 122.099 0.042 . . . . . . . 592 R N . 52160 1
64 . 1 . 1 28 28 GLY H H 1 8.393 0.001 . . . . . . . 593 G HN . 52160 1
65 . 1 . 1 28 28 GLY CA C 13 45.172 0.056 . . . . . . . 593 G CA . 52160 1
66 . 1 . 1 28 28 GLY N N 15 110.250 0.000 . . . . . . . 593 G N . 52160 1
67 . 1 . 1 29 29 ARG H H 1 8.053 0.002 . . . . . . . 594 R HN . 52160 1
68 . 1 . 1 29 29 ARG CA C 13 55.884 0.000 . . . . . . . 594 R CA . 52160 1
69 . 1 . 1 29 29 ARG CB C 13 30.892 0.000 . . . . . . . 594 R CB . 52160 1
70 . 1 . 1 29 29 ARG N N 15 120.830 0.001 . . . . . . . 594 R N . 52160 1
71 . 1 . 1 30 30 ALA H H 1 7.948 0.000 . . . . . . . 595 A HN . 52160 1
72 . 1 . 1 30 30 ALA N N 15 110.969 0.000 . . . . . . . 595 A N . 52160 1
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