Content for NMR-STAR saveframe, "coupling_constant"
save_coupling_constant
_Coupling_constant_list.Sf_category coupling_constants
_Coupling_constant_list.Sf_framecode coupling_constant
_Coupling_constant_list.Entry_ID 4347
_Coupling_constant_list.ID 1
_Coupling_constant_list.Sample_condition_list_ID 1
_Coupling_constant_list.Sample_condition_list_label $sample_conditions_one
_Coupling_constant_list.Spectrometer_frequency_1H .
_Coupling_constant_list.Details
;
3JHNHA coupling constants were measured at two transforms, one phased in pure absorption
and the other in pure dispersion, of the DQF-COSY spectrum. From these values the real
coupling constants were calculated according to Kim, Y. and Prestegard, J.H. (1989)
J. Magn. Reson. 84, 9-13
;
_Coupling_constant_list.Text_data_format .
_Coupling_constant_list.Text_data .
loop_
_Coupling_constant_experiment.Experiment_ID
_Coupling_constant_experiment.Experiment_name
_Coupling_constant_experiment.Sample_ID
_Coupling_constant_experiment.Sample_label
_Coupling_constant_experiment.Sample_state
_Coupling_constant_experiment.Entry_ID
_Coupling_constant_experiment.Coupling_constant_list_ID
. . 1 $sample_one . 4347 1
stop_
loop_
_Coupling_constant.ID
_Coupling_constant.Code
_Coupling_constant.Assembly_atom_ID_1
_Coupling_constant.Entity_assembly_ID_1
_Coupling_constant.Entity_ID_1
_Coupling_constant.Comp_index_ID_1
_Coupling_constant.Seq_ID_1
_Coupling_constant.Comp_ID_1
_Coupling_constant.Atom_ID_1
_Coupling_constant.Atom_type_1
_Coupling_constant.Atom_isotope_number_1
_Coupling_constant.Ambiguity_code_1
_Coupling_constant.Assembly_atom_ID_2
_Coupling_constant.Entity_assembly_ID_2
_Coupling_constant.Entity_ID_2
_Coupling_constant.Comp_index_ID_2
_Coupling_constant.Seq_ID_2
_Coupling_constant.Comp_ID_2
_Coupling_constant.Atom_ID_2
_Coupling_constant.Atom_type_2
_Coupling_constant.Atom_isotope_number_2
_Coupling_constant.Ambiguity_code_2
_Coupling_constant.Val
_Coupling_constant.Val_min
_Coupling_constant.Val_max
_Coupling_constant.Val_err
_Coupling_constant.Resonance_ID_1
_Coupling_constant.Resonance_ID_2
_Coupling_constant.Auth_entity_assembly_ID_1
_Coupling_constant.Auth_seq_ID_1
_Coupling_constant.Auth_comp_ID_1
_Coupling_constant.Auth_atom_ID_1
_Coupling_constant.Auth_entity_assembly_ID_2
_Coupling_constant.Auth_seq_ID_2
_Coupling_constant.Auth_comp_ID_2
_Coupling_constant.Auth_atom_ID_2
_Coupling_constant.Details
_Coupling_constant.Entry_ID
_Coupling_constant.Coupling_constant_list_ID
1 3JHNHA . 1 1 3 3 GLU H H 1 . . 1 1 3 3 GLU HA H 1 . 11.0 . . 1.0 . . . . . . . . . . . 4347 1
2 3JHNHA . 1 1 4 4 VAL H H 1 . . 1 1 4 4 VAL HA H 1 . 3.0 . . 1.0 . . . . . . . . . . . 4347 1
3 3JHNHA . 1 1 5 5 GLU H H 1 . . 1 1 5 5 GLU HA H 1 . 6.0 . . 1.0 . . . . . . . . . . . 4347 1
4 3JHNHA . 1 1 6 6 GLU H H 1 . . 1 1 6 6 GLU HA H 1 . 4.0 . . 1.0 . . . . . . . . . . . 4347 1
5 3JHNHA . 1 1 7 7 LEU H H 1 . . 1 1 7 7 LEU HA H 1 . 4.0 . . 1.0 . . . . . . . . . . . 4347 1
6 3JHNHA . 1 1 8 8 GLU H H 1 . . 1 1 8 8 GLU HA H 1 . 4.5 . . 1.0 . . . . . . . . . . . 4347 1
7 3JHNHA . 1 1 9 9 LYS H H 1 . . 1 1 9 9 LYS HA H 1 . 4.5 . . 1.0 . . . . . . . . . . . 4347 1
8 3JHNHA . 1 1 10 10 LYS H H 1 . . 1 1 10 10 LYS HA H 1 . 6.0 . . 1.0 . . . . . . . . . . . 4347 1
9 3JHNHA . 1 1 11 11 PHE H H 1 . . 1 1 11 11 PHE HA H 1 . 5.0 . . 1.0 . . . . . . . . . . . 4347 1
10 3JHNHA . 1 1 12 12 LYS H H 1 . . 1 1 12 12 LYS HA H 1 . 6.0 . . 1.0 . . . . . . . . . . . 4347 1
11 3JHNHA . 1 1 13 13 GLU H H 1 . . 1 1 13 13 GLU HA H 1 . 5.0 . . 1.0 . . . . . . . . . . . 4347 1
12 3JHNHA . 1 1 14 14 LEU H H 1 . . 1 1 14 14 LEU HA H 1 . 3.0 . . 1.0 . . . . . . . . . . . 4347 1
13 3JHNHA . 1 1 16 16 LYS H H 1 . . 1 1 16 16 LYS HA H 1 . 7.0 . . 1.0 . . . . . . . . . . . 4347 1
14 3JHNHA . 1 1 19 19 ARG H H 1 . . 1 1 19 19 ARG HA H 1 . 7.0 . . 1.0 . . . . . . . . . . . 4347 1
15 3JHNHA . 1 1 21 21 GLY H H 1 . . 1 1 21 21 GLY HA H 1 . 10.0 . . 1.0 . . . . . . . . . . . 4347 1
16 3JHNHA . 1 1 22 22 GLU H H 1 . . 1 1 22 22 GLU HA H 1 . 10.0 . . 1.0 . . . . . . . . . . . 4347 1
17 3JHNHA . 1 1 23 23 ILE H H 1 . . 1 1 23 23 ILE HA H 1 . 4.0 . . 1.0 . . . . . . . . . . . 4347 1
18 3JHNHA . 1 1 24 24 GLU H H 1 . . 1 1 24 24 GLU HA H 1 . 7.0 . . 1.0 . . . . . . . . . . . 4347 1
19 3JHNHA . 1 1 25 25 GLU H H 1 . . 1 1 25 25 GLU HA H 1 . 5.0 . . 1.0 . . . . . . . . . . . 4347 1
20 3JHNHA . 1 1 26 26 LEU H H 1 . . 1 1 26 26 LEU HA H 1 . 5.0 . . 1.0 . . . . . . . . . . . 4347 1
21 3JHNHA . 1 1 28 28 LYS H H 1 . . 1 1 28 28 LYS HA H 1 . 5.0 . . 1.0 . . . . . . . . . . . 4347 1
22 3JHNHA . 1 1 29 29 LYS H H 1 . . 1 1 29 29 LYS HA H 1 . 7.0 . . 1.0 . . . . . . . . . . . 4347 1
23 3JHNHA . 1 1 30 30 PHE H H 1 . . 1 1 30 30 PHE HA H 1 . 12.0 . . 1.0 . . . . . . . . . . . 4347 1
24 3JHNHA . 1 1 32 32 GLU H H 1 . . 1 1 32 32 GLU HA H 1 . 5.0 . . 1.0 . . . . . . . . . . . 4347 1
25 3JHNHA . 1 1 33 33 LEU H H 1 . . 1 1 33 33 LEU HA H 1 . 4.0 . . 1.0 . . . . . . . . . . . 4347 1
26 3JHNHA . 1 1 34 34 ILE H H 1 . . 1 1 34 34 ILE HA H 1 . 6.0 . . 1.0 . . . . . . . . . . . 4347 1
27 3JHNHA . 1 1 35 35 LYS H H 1 . . 1 1 35 35 LYS HA H 1 . 5.0 . . 1.0 . . . . . . . . . . . 4347 1
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