Content for NMR-STAR saveframe, "heteronuclear_T2_list_Excited"
save_heteronuclear_T2_list_Excited
_Heteronucl_T2_list.Sf_category heteronucl_T2_relaxation
_Heteronucl_T2_list.Sf_framecode heteronuclear_T2_list_Excited
_Heteronucl_T2_list.Entry_ID 26520
_Heteronucl_T2_list.ID 2
_Heteronucl_T2_list.Sample_condition_list_ID 1
_Heteronucl_T2_list.Sample_condition_list_label $sample_conditions_1
_Heteronucl_T2_list.Temp_calibration_method 'no calibration applied'
_Heteronucl_T2_list.Temp_control_method 'no temperature control applied'
_Heteronucl_T2_list.Spectrometer_frequency_1H 500
_Heteronucl_T2_list.T2_coherence_type S(+,-)
_Heteronucl_T2_list.T2_val_units s-1
_Heteronucl_T2_list.Rex_units .
_Heteronucl_T2_list.Details
;
Excited State
Values of obtained from fits of all CEST profiles recorded on the
A39G FF domain, 1C, 11.7T to a global two-site exchange processes. Values of (kex,pE) were
fixed to (51.6 s-1,1.65%) and profiles for all of the residues fit simultaneously.
The 37 residues that showed clear evidence for a second state are as follows (well resolved
dips for both ground and excited states in profiles)
10
13
15
18
22
25
26
27
28
29
33
37
38
39
41
42
43
44
45
48
50
51
52
53
54
55
56
59
60
61
63
64
65
66
67
68
69
;
_Heteronucl_T2_list.Text_data_format .
_Heteronucl_T2_list.Text_data .
loop_
_Heteronucl_T2_experiment.Experiment_ID
_Heteronucl_T2_experiment.Experiment_name
_Heteronucl_T2_experiment.Sample_ID
_Heteronucl_T2_experiment.Sample_label
_Heteronucl_T2_experiment.Sample_state
_Heteronucl_T2_experiment.Entry_ID
_Heteronucl_T2_experiment.Heteronucl_T2_list_ID
1 '2D 1H-15N HSQC' . . . 26520 2
2 '2D 1H-15N HMQC' . . . 26520 2
stop_
loop_
_T2.ID
_T2.Assembly_atom_ID
_T2.Entity_assembly_ID
_T2.Entity_ID
_T2.Comp_index_ID
_T2.Seq_ID
_T2.Comp_ID
_T2.Atom_ID
_T2.Atom_type
_T2.Atom_isotope_number
_T2.T2_val
_T2.T2_val_err
_T2.Rex_val
_T2.Rex_err
_T2.Resonance_ID
_T2.Auth_entity_assembly_ID
_T2.Auth_seq_ID
_T2.Auth_comp_ID
_T2.Auth_atom_ID
_T2.Entry_ID
_T2.Heteronucl_T2_list_ID
1 . 1 1 3 3 GLN N N 15 0.9 5.2 . . . . . . . 26520 2
2 . 1 1 5 5 ALA N N 15 0.3 4.3 . . . . . . . 26520 2
3 . 1 1 6 6 LYS N N 15 0.0 3.3 . . . . . . . 26520 2
4 . 1 1 7 7 LYS N N 15 0.5 3.7 . . . . . . . 26520 2
5 . 1 1 8 8 THR N N 15 7.9 2.9 . . . . . . . 26520 2
6 . 1 1 9 9 TYR N N 15 19.1 7.1 . . . . . . . 26520 2
7 . 1 1 10 10 THR N N 15 27.2 5.2 . . . . . . . 26520 2
8 . 1 1 11 11 TRP N N 15 42.5 18.4 . . . . . . . 26520 2
9 . 1 1 12 12 ASN N N 15 1.0 7.0 . . . . . . . 26520 2
10 . 1 1 13 13 THR N N 15 120.2 6.3 . . . . . . . 26520 2
11 . 1 1 14 14 LYS N N 15 14.6 8.8 . . . . . . . 26520 2
12 . 1 1 15 15 GLU N N 15 35.7 3.4 . . . . . . . 26520 2
13 . 1 1 16 16 GLU N N 15 26.0 4.8 . . . . . . . 26520 2
14 . 1 1 17 17 ALA N N 15 13.1 3.9 . . . . . . . 26520 2
15 . 1 1 18 18 LYS N N 15 39.3 4.3 . . . . . . . 26520 2
16 . 1 1 19 19 GLN N N 15 39.1 4.6 . . . . . . . 26520 2
17 . 1 1 20 20 ALA N N 15 66.5 33.9 . . . . . . . 26520 2
18 . 1 1 21 21 PHE N N 15 33.4 7.8 . . . . . . . 26520 2
19 . 1 1 22 22 LYS N N 15 75.1 5.4 . . . . . . . 26520 2
20 . 1 1 23 23 GLU N N 15 33.9 18.1 . . . . . . . 26520 2
21 . 1 1 24 24 LEU N N 15 28.6 10.9 . . . . . . . 26520 2
22 . 1 1 25 25 LEU N N 15 62.7 6.4 . . . . . . . 26520 2
23 . 1 1 26 26 LYS N N 15 92.9 5.9 . . . . . . . 26520 2
24 . 1 1 27 27 GLU N N 15 64.8 5.9 . . . . . . . 26520 2
25 . 1 1 28 28 LYS N N 15 204.9 11.4 . . . . . . . 26520 2
26 . 1 1 29 29 ARG N N 15 163.1 9.3 . . . . . . . 26520 2
27 . 1 1 30 30 VAL N N 15 88.2 6.8 . . . . . . . 26520 2
28 . 1 1 32 32 SER N N 15 28.4 6.2 . . . . . . . 26520 2
29 . 1 1 33 33 ASN N N 15 85.8 4.8 . . . . . . . 26520 2
30 . 1 1 34 34 ALA N N 15 17.8 2.8 . . . . . . . 26520 2
31 . 1 1 35 35 SER N N 15 28.4 3.9 . . . . . . . 26520 2
32 . 1 1 36 36 TRP N N 15 7.1 8.4 . . . . . . . 26520 2
33 . 1 1 37 37 GLU N N 15 100.7 6.3 . . . . . . . 26520 2
34 . 1 1 38 38 GLN N N 15 18.9 4.5 . . . . . . . 26520 2
35 . 1 1 39 39 ALA N N 15 30.1 4.5 . . . . . . . 26520 2
36 . 1 1 40 40 MET N N 15 14.6 4.7 . . . . . . . 26520 2
37 . 1 1 41 41 LYS N N 15 103.4 6.5 . . . . . . . 26520 2
38 . 1 1 42 42 MET N N 15 165.0 11.1 . . . . . . . 26520 2
39 . 1 1 43 43 ILE N N 15 217.1 14.6 . . . . . . . 26520 2
40 . 1 1 44 44 ILE N N 15 197.0 13.6 . . . . . . . 26520 2
41 . 1 1 45 45 ASN N N 15 161.9 7.4 . . . . . . . 26520 2
42 . 1 1 46 46 ASP N N 15 28.2 4.7 . . . . . . . 26520 2
43 . 1 1 48 48 ARG N N 15 29.0 4.2 . . . . . . . 26520 2
44 . 1 1 50 50 SER N N 15 70.1 4.7 . . . . . . . 26520 2
45 . 1 1 51 51 ALA N N 15 59.5 6.4 . . . . . . . 26520 2
46 . 1 1 52 52 LEU N N 15 21.9 8.6 . . . . . . . 26520 2
47 . 1 1 53 53 ALA N N 15 47.6 4.4 . . . . . . . 26520 2
48 . 1 1 54 54 LYS N N 15 69.5 3.8 . . . . . . . 26520 2
49 . 1 1 55 55 LEU N N 15 35.0 4.4 . . . . . . . 26520 2
50 . 1 1 56 56 SER N N 15 88.1 6.3 . . . . . . . 26520 2
51 . 1 1 57 57 GLU N N 15 38.2 7.2 . . . . . . . 26520 2
52 . 1 1 58 58 LYS N N 15 40.3 8.8 . . . . . . . 26520 2
53 . 1 1 59 59 LYS N N 15 38.5 5.9 . . . . . . . 26520 2
54 . 1 1 60 60 GLN N N 15 33.9 3.2 . . . . . . . 26520 2
55 . 1 1 61 61 ALA N N 15 18.8 3.4 . . . . . . . 26520 2
56 . 1 1 62 62 PHE N N 15 13.7 4.5 . . . . . . . 26520 2
57 . 1 1 63 63 ASN N N 15 39.9 4.0 . . . . . . . 26520 2
58 . 1 1 64 64 ALA N N 15 20.7 3.4 . . . . . . . 26520 2
59 . 1 1 65 65 TYR N N 15 21.7 4.3 . . . . . . . 26520 2
60 . 1 1 66 66 LYS N N 15 49.5 5.2 . . . . . . . 26520 2
61 . 1 1 67 67 VAL N N 15 62.0 3.8 . . . . . . . 26520 2
62 . 1 1 68 68 GLN N N 15 44.0 2.9 . . . . . . . 26520 2
63 . 1 1 69 69 THR N N 15 12.5 2.0 . . . . . . . 26520 2
64 . 1 1 70 70 GLU N N 15 3.1 1.6 . . . . . . . 26520 2
65 . 1 1 71 71 LYS N N 15 1.0 5.0 . . . . . . . 26520 2
stop_
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