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 |
|
|
35607 |
1ly7   |
4342 | cing | 2-parsed | STAR | dihedral angle | 48 |
data_1ly7_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1ly7
_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_1ly7 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1ly7
_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 1ly7 "Master copy" parsed_1ly7
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1ly7
_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 1ly7.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1ly7 1
1 1ly7.mr . . XPLOR/CNS 2 distance NOE ambi 2339 parsed_1ly7 1
1 1ly7.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 48 parsed_1ly7 1
1 1ly7.mr . . n/a 4 comment "Not applicable" "Not applicable" 0 parsed_1ly7 1
1 1ly7.mr . . XPLOR/CNS 5 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_1ly7 1
1 1ly7.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1ly7 1
stop_
save_
save_CNS/XPLOR_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_1ly7
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 3
_Torsion_angle_constraint_list.Details "Generated by Wattos"
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Assembly_atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Seq_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Resonance_ID_1
_Torsion_angle_constraint.Assembly_atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Seq_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Resonance_ID_2
_Torsion_angle_constraint.Assembly_atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Seq_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Resonance_ID_3
_Torsion_angle_constraint.Assembly_atom_ID_4
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Seq_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Resonance_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Source_experiment_ID
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -20.00 . . 14 . C . 15 . N . 15 . CA . 15 . C parsed_1ly7 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -20.00 . . 15 . C . 16 . N . 16 . CA . 16 . C parsed_1ly7 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -20.00 . . 16 . C . 17 . N . 17 . CA . 17 . C parsed_1ly7 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -20.00 . . 17 . C . 18 . N . 18 . CA . 18 . C parsed_1ly7 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -20.00 . . 18 . C . 19 . N . 19 . CA . 19 . C parsed_1ly7 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -20.00 . . 19 . C . 20 . N . 20 . CA . 20 . C parsed_1ly7 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -20.00 . . 20 . C . 21 . N . 21 . CA . 21 . C parsed_1ly7 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -20.00 . . 21 . C . 22 . N . 22 . CA . 22 . C parsed_1ly7 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -20.00 . . 22 . C . 23 . N . 23 . CA . 23 . C parsed_1ly7 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -20.00 . . 24 . C . 25 . N . 25 . CA . 25 . C parsed_1ly7 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -20.00 . . 25 . C . 26 . N . 26 . CA . 26 . C parsed_1ly7 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -20.00 . . 26 . C . 27 . N . 27 . CA . 27 . C parsed_1ly7 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -20.00 . . 27 . C . 28 . N . 28 . CA . 28 . C parsed_1ly7 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -20.00 . . 28 . C . 29 . N . 29 . CA . 29 . C parsed_1ly7 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -20.00 . . 29 . C . 30 . N . 30 . CA . 30 . C parsed_1ly7 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -20.00 . . 32 . C . 33 . N . 33 . CA . 33 . C parsed_1ly7 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -20.00 . . 33 . C . 34 . N . 34 . CA . 34 . C parsed_1ly7 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -80.00 . . 43 . C . 44 . N . 44 . CA . 44 . C parsed_1ly7 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -80.00 . . 44 . C . 45 . N . 45 . CA . 45 . C parsed_1ly7 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -80.00 . . 45 . C . 46 . N . 46 . CA . 46 . C parsed_1ly7 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -80.00 . . 46 . C . 47 . N . 47 . CA . 47 . C parsed_1ly7 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -80.00 . . 50 . C . 51 . N . 51 . CA . 51 . C parsed_1ly7 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -80.00 . . 51 . C . 52 . N . 52 . CA . 52 . C parsed_1ly7 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -80.00 . . 52 . C . 53 . N . 53 . CA . 53 . C parsed_1ly7 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -80.00 . . 53 . C . 54 . N . 54 . CA . 54 . C parsed_1ly7 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -80.00 . . 54 . C . 55 . N . 55 . CA . 55 . C parsed_1ly7 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -80.00 . . 61 . C . 62 . N . 62 . CA . 62 . C parsed_1ly7 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -80.00 . . 62 . C . 63 . N . 63 . CA . 63 . C parsed_1ly7 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -80.00 . . 63 . C . 64 . N . 64 . CA . 64 . C parsed_1ly7 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -80.00 . . 64 . C . 65 . N . 65 . CA . 65 . C parsed_1ly7 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -80.00 . . 66 . C . 67 . N . 67 . CA . 67 . C parsed_1ly7 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -80.00 . . 74 . C . 75 . N . 75 . CA . 75 . C parsed_1ly7 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -80.00 . . 75 . C . 76 . N . 76 . CA . 76 . C parsed_1ly7 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -80.00 . . 76 . C . 77 . N . 77 . CA . 77 . C parsed_1ly7 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -80.00 . . 77 . C . 78 . N . 78 . CA . 78 . C parsed_1ly7 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -80.00 . . 83 . C . 84 . N . 84 . CA . 84 . C parsed_1ly7 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -80.00 . . 84 . C . 85 . N . 85 . CA . 85 . C parsed_1ly7 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -80.00 . . 86 . C . 87 . N . 87 . CA . 87 . C parsed_1ly7 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -80.00 . . 87 . C . 88 . N . 88 . CA . 88 . C parsed_1ly7 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -80.00 . . 88 . C . 89 . N . 89 . CA . 89 . C parsed_1ly7 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -80.00 . . 91 . C . 92 . N . 92 . CA . 92 . C parsed_1ly7 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -80.00 . . 92 . C . 93 . N . 93 . CA . 93 . C parsed_1ly7 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -80.00 . . 94 . C . 95 . N . 95 . CA . 95 . C parsed_1ly7 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -20.00 . . 103 . C . 104 . N . 104 . CA . 104 . C parsed_1ly7 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -20.00 . . 104 . C . 105 . N . 105 . CA . 105 . C parsed_1ly7 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -20.00 . . 105 . C . 106 . N . 106 . CA . 106 . C parsed_1ly7 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -20.00 . . 106 . C . 107 . N . 107 . CA . 107 . C parsed_1ly7 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -20.00 . . 108 . C . 109 . N . 109 . CA . 109 . C parsed_1ly7 1
stop_
loop_
_TA_constraint_comment_org.ID
_TA_constraint_comment_org.Comment_text
_TA_constraint_comment_org.Comment_begin_line
_TA_constraint_comment_org.Comment_begin_column
_TA_constraint_comment_org.Comment_end_line
_TA_constraint_comment_org.Comment_end_column
_TA_constraint_comment_org.Entry_ID
_TA_constraint_comment_org.Torsion_angle_constraint_list_ID
1 "15 J= 2.80" 2 1 2 15 parsed_1ly7 1
2 "16 J= 5.14" 6 1 6 15 parsed_1ly7 1
3 "17 J= 6.83" 10 1 10 15 parsed_1ly7 1
4 "18 J= 5.92" 14 1 14 15 parsed_1ly7 1
5 "19 J= 4.28" 18 1 18 15 parsed_1ly7 1
6 "20 J= 4.79" 22 1 22 15 parsed_1ly7 1
7 "21 J= 6.78" 26 1 26 15 parsed_1ly7 1
8 "22 J= 5.14" 30 1 30 15 parsed_1ly7 1
9 "23 J= 4.72" 33 1 33 15 parsed_1ly7 1
10 "25 J= 5.21" 37 1 37 15 parsed_1ly7 1
11 "26 J= 5.53" 41 1 41 15 parsed_1ly7 1
12 "27 J= 6.09" 45 1 45 15 parsed_1ly7 1
13 "28 J= 4.25" 49 1 49 15 parsed_1ly7 1
14 "29 J= 4.78" 53 1 53 15 parsed_1ly7 1
15 "30 J= 4.90" 57 1 57 15 parsed_1ly7 1
16 "33 J= 4.90" 61 1 61 15 parsed_1ly7 1
17 "34 J= 4.48" 64 1 64 15 parsed_1ly7 1
18 "44 J= 6.94" 68 1 68 15 parsed_1ly7 1
19 "45 J= 9.85" 72 1 72 15 parsed_1ly7 1
20 "46 J=10.09" 76 1 76 15 parsed_1ly7 1
21 "47 J= 7.36" 80 1 80 15 parsed_1ly7 1
22 "51 J=12.23" 84 1 84 15 parsed_1ly7 1
23 "52 J= 7.93" 88 1 88 15 parsed_1ly7 1
24 "53 J=10.33" 92 1 92 15 parsed_1ly7 1
25 "54 J= 7.52" 95 1 95 15 parsed_1ly7 1
26 "55 J=10.35" 99 1 99 15 parsed_1ly7 1
27 "62 J= 7.16" 103 1 103 15 parsed_1ly7 1
28 "63 J= 9.24" 107 1 107 15 parsed_1ly7 1
29 "64 J=10.98" 111 1 111 15 parsed_1ly7 1
30 "65 J= 9.13" 115 1 115 15 parsed_1ly7 1
31 "67 J= 8.85" 119 1 119 15 parsed_1ly7 1
32 "75 J= 9.01" 123 1 123 15 parsed_1ly7 1
33 "76 J=11.11" 126 1 126 15 parsed_1ly7 1
34 "77 J=13.01" 130 1 130 15 parsed_1ly7 1
35 "78 J= 7.82" 134 1 134 15 parsed_1ly7 1
36 "84 J=11.79" 138 1 138 15 parsed_1ly7 1
37 "85 J= 6.59" 142 1 142 15 parsed_1ly7 1
38 "87 J=10.33" 146 1 146 15 parsed_1ly7 1
39 "88 J= 8.10" 150 1 150 15 parsed_1ly7 1
40 "89 J= 9.10" 154 1 154 15 parsed_1ly7 1
41 "92 J= 8.48" 157 1 157 15 parsed_1ly7 1
42 "93 J= 7.45" 161 1 161 15 parsed_1ly7 1
43 "95 J= 9.94" 165 1 165 15 parsed_1ly7 1
44 "104 J= 5.85" 169 1 169 15 parsed_1ly7 1
45 "105 J= 5.62" 173 1 173 15 parsed_1ly7 1
46 "106 J= 4.44" 177 1 177 15 parsed_1ly7 1
47 "107 J= 6.54" 181 1 181 15 parsed_1ly7 1
48 "109 J= 3.70" 185 1 185 15 parsed_1ly7 1
stop_
save_
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