NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
51791 |
2kae   |
16812 | cing | 2-parsed | STAR | dipolar coupling | 42 |
data_2kae_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2kae
_Study_list.ID 1
loop_
_Study.ID
_Study.Name
_Study.Type
_Study.Details
_Study.Entry_ID
_Study.Study_list_ID
1 "Conversion project" NMR . parsed_2kae 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2kae
_Entry.Title "Original constraint list(s)"
_Entry.Version_type original
_Entry.Submission_date .
_Entry.Accession_date .
_Entry.Last_release_date .
_Entry.Original_release_date .
_Entry.Origination .
_Entry.NMR_STAR_version 3.1
_Entry.Original_NMR_STAR_version .
_Entry.Experimental_method NMR
_Entry.Experimental_method_subtype .
loop_
_Related_entries.Database_name
_Related_entries.Database_accession_code
_Related_entries.Relationship
_Related_entries.Entry_ID
PDB 2kae "Master copy" parsed_2kae
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2kae
_Constraint_stat_list.ID 1
loop_
_Constraint_file.ID
_Constraint_file.Constraint_filename
_Constraint_file.Software_ID
_Constraint_file.Software_label
_Constraint_file.Software_name
_Constraint_file.Block_ID
_Constraint_file.Constraint_type
_Constraint_file.Constraint_subtype
_Constraint_file.Constraint_subsubtype
_Constraint_file.Constraint_number
_Constraint_file.Entry_ID
_Constraint_file.Constraint_stat_list_ID
1 2kae.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2kae 1
1 2kae.mr . . XPLOR/CNS 2 "dihedral angle" "Not applicable" "Not applicable" 52 parsed_2kae 1
1 2kae.mr . . HADDOCK 3 distance NOE ambi 0 parsed_2kae 1
1 2kae.mr . . XPLOR/CNS 4 distance NOE simple 471 parsed_2kae 1
1 2kae.mr . . XPLOR/CNS 5 distance "general distance" simple 114 parsed_2kae 1
1 2kae.mr . . XPLOR/CNS 6 "dipolar coupling" "Not applicable" "Not applicable" 42 parsed_2kae 1
1 2kae.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2kae 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_6
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2kae
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 6
_RDC_constraint_list.Details "Generated by Wattos"
loop_
_RDC_constraint.ID
_RDC_constraint.Assembly_atom_ID_1
_RDC_constraint.Entity_assembly_ID_1
_RDC_constraint.Entity_ID_1
_RDC_constraint.Comp_index_ID_1
_RDC_constraint.Seq_ID_1
_RDC_constraint.Comp_ID_1
_RDC_constraint.Atom_ID_1
_RDC_constraint.Resonance_ID_1
_RDC_constraint.Assembly_atom_ID_2
_RDC_constraint.Entity_assembly_ID_2
_RDC_constraint.Entity_ID_2
_RDC_constraint.Comp_index_ID_2
_RDC_constraint.Seq_ID_2
_RDC_constraint.Comp_ID_2
_RDC_constraint.Atom_ID_2
_RDC_constraint.Resonance_ID_2
_RDC_constraint.RDC_val
_RDC_constraint.RDC_lower_bound
_RDC_constraint.RDC_upper_bound
_RDC_constraint.RDC_val_err
_RDC_constraint.Source_experiment_ID
_RDC_constraint.Auth_asym_ID_1
_RDC_constraint.Auth_seq_ID_1
_RDC_constraint.Auth_comp_ID_1
_RDC_constraint.Auth_atom_ID_1
_RDC_constraint.Auth_asym_ID_2
_RDC_constraint.Auth_seq_ID_2
_RDC_constraint.Auth_comp_ID_2
_RDC_constraint.Auth_atom_ID_2
_RDC_constraint.Entry_ID
_RDC_constraint.RDC_constraint_list_ID
1 . . . . . . . . . . . . . . . . -5.650 . . . . A 113 . N A 113 . HN parsed_2kae 1
2 . . . . . . . . . . . . . . . . -4.380 . . . . A 114 . N A 114 . HN parsed_2kae 1
3 . . . . . . . . . . . . . . . . -1.040 . . . . A 115 . N A 115 . HN parsed_2kae 1
4 . . . . . . . . . . . . . . . . 13.200 . . . . A 116 . N A 116 . HN parsed_2kae 1
5 . . . . . . . . . . . . . . . . -7.540 . . . . A 118 . N A 118 . HN parsed_2kae 1
6 . . . . . . . . . . . . . . . . -13.380 . . . . A 120 . N A 120 . HN parsed_2kae 1
7 . . . . . . . . . . . . . . . . -13.620 . . . . A 121 . N A 121 . HN parsed_2kae 1
8 . . . . . . . . . . . . . . . . -4.560 . . . . A 122 . N A 122 . HN parsed_2kae 1
9 . . . . . . . . . . . . . . . . -20.250 . . . . A 123 . N A 123 . HN parsed_2kae 1
10 . . . . . . . . . . . . . . . . -5.580 . . . . A 124 . N A 124 . HN parsed_2kae 1
11 . . . . . . . . . . . . . . . . -6.440 . . . . A 125 . N A 125 . HN parsed_2kae 1
12 . . . . . . . . . . . . . . . . -0.920 . . . . A 126 . N A 126 . HN parsed_2kae 1
13 . . . . . . . . . . . . . . . . 20.560 . . . . A 127 . N A 127 . HN parsed_2kae 1
14 . . . . . . . . . . . . . . . . 13.680 . . . . A 128 . N A 128 . HN parsed_2kae 1
15 . . . . . . . . . . . . . . . . 12.900 . . . . A 129 . N A 129 . HN parsed_2kae 1
16 . . . . . . . . . . . . . . . . -3.030 . . . . A 130 . N A 130 . HN parsed_2kae 1
17 . . . . . . . . . . . . . . . . 2.420 . . . . A 131 . N A 131 . HN parsed_2kae 1
18 . . . . . . . . . . . . . . . . 2.800 . . . . A 132 . N A 132 . HN parsed_2kae 1
19 . . . . . . . . . . . . . . . . -18.000 . . . . A 133 . N A 133 . HN parsed_2kae 1
20 . . . . . . . . . . . . . . . . -2.380 . . . . A 135 . N A 135 . HN parsed_2kae 1
21 . . . . . . . . . . . . . . . . -1.460 . . . . A 136 . N A 136 . HN parsed_2kae 1
22 . . . . . . . . . . . . . . . . 5.230 . . . . A 137 . N A 137 . HN parsed_2kae 1
23 . . . . . . . . . . . . . . . . 1.410 . . . . A 138 . N A 138 . HN parsed_2kae 1
24 . . . . . . . . . . . . . . . . 5.110 . . . . A 139 . N A 139 . HN parsed_2kae 1
25 . . . . . . . . . . . . . . . . 10.520 . . . . A 140 . N A 140 . HN parsed_2kae 1
26 . . . . . . . . . . . . . . . . 9.430 . . . . A 141 . N A 141 . HN parsed_2kae 1
27 . . . . . . . . . . . . . . . . 2.730 . . . . A 142 . N A 142 . HN parsed_2kae 1
28 . . . . . . . . . . . . . . . . 8.040 . . . . A 144 . N A 144 . HN parsed_2kae 1
29 . . . . . . . . . . . . . . . . 7.410 . . . . A 146 . N A 146 . HN parsed_2kae 1
30 . . . . . . . . . . . . . . . . 17.940 . . . . A 148 . N A 148 . HN parsed_2kae 1
31 . . . . . . . . . . . . . . . . 10.710 . . . . A 149 . N A 149 . HN parsed_2kae 1
32 . . . . . . . . . . . . . . . . -23.050 . . . . A 150 . N A 150 . HN parsed_2kae 1
33 . . . . . . . . . . . . . . . . 12.410 . . . . A 152 . N A 152 . HN parsed_2kae 1
34 . . . . . . . . . . . . . . . . 7.900 . . . . A 153 . N A 153 . HN parsed_2kae 1
35 . . . . . . . . . . . . . . . . 3.950 . . . . A 154 . N A 154 . HN parsed_2kae 1
36 . . . . . . . . . . . . . . . . 12.960 . . . . A 155 . N A 155 . HN parsed_2kae 1
37 . . . . . . . . . . . . . . . . 10.400 . . . . A 158 . N A 158 . HN parsed_2kae 1
38 . . . . . . . . . . . . . . . . 9.910 . . . . A 159 . N A 159 . HN parsed_2kae 1
39 . . . . . . . . . . . . . . . . 6.800 . . . . A 160 . N A 160 . HN parsed_2kae 1
40 . . . . . . . . . . . . . . . . 4.260 . . . . A 163 . N A 163 . HN parsed_2kae 1
41 . . . . . . . . . . . . . . . . 1.830 . . . . A 165 . N A 165 . HN parsed_2kae 1
42 . . . . . . . . . . . . . . . . 5.170 . . . . A 166 . N A 166 . HN parsed_2kae 1
stop_
save_
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