NMR Restraints Grid
| |
NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
475251 |
2l12   |
17072 | cing | 2-parsed | STAR | dihedral angle | 68 |
data_2l12_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2l12
_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_2l12 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2l12
_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 2l12 "Master copy" parsed_2l12
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2l12
_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 2l12.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2l12 1
1 2l12.mr . . XPLOR/CNS 2 "dihedral angle" "Not applicable" "Not applicable" 68 parsed_2l12 1
1 2l12.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 0 parsed_2l12 1
1 2l12.mr . . XPLOR/CNS 4 distance NOE simple 0 parsed_2l12 1
1 2l12.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2l12 1
stop_
save_
save_CNS/XPLOR_dihedral_2
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2l12
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 2
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -104.60 . . 4 . C . 5 . N . 5 . CA . 5 . C parsed_2l12 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 133.30 180.80 . . 5 . N . 5 . CA . 5 . C . 6 . N parsed_2l12 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -117.00 -61.00 . . 5 . C . 6 . N . 6 . CA . 6 . C parsed_2l12 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 104.00 152.00 . . 6 . N . 6 . CA . 6 . C . 7 . N parsed_2l12 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -177.00 -49.00 . . 6 . C . 7 . N . 7 . CA . 7 . C parsed_2l12 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 117.00 153.00 . . 7 . N . 7 . CA . 7 . C . 8 . N parsed_2l12 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -191.40 -105.90 . . 8 . C . 9 . N . 9 . CA . 9 . C parsed_2l12 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 125.40 201.30 . . 9 . N . 9 . CA . 9 . C . 10 . N parsed_2l12 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -148.00 -68.00 . . 9 . C . 10 . N . 10 . CA . 10 . C parsed_2l12 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 106.00 154.00 . . 10 . N . 10 . CA . 10 . C . 11 . N parsed_2l12 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -169.40 -117.40 . . 11 . C . 12 . N . 12 . CA . 12 . C parsed_2l12 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 118.90 179.60 . . 12 . N . 12 . CA . 12 . C . 13 . N parsed_2l12 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.00 -79.00 . . 12 . C . 13 . N . 13 . CA . 13 . C parsed_2l12 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 108.00 168.00 . . 13 . N . 13 . CA . 13 . C . 14 . N parsed_2l12 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -194.90 -79.10 . . 13 . C . 14 . N . 14 . CA . 14 . C parsed_2l12 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 111.20 184.50 . . 14 . N . 14 . CA . 14 . C . 15 . N parsed_2l12 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -144.00 -88.00 . . 14 . C . 15 . N . 15 . CA . 15 . C parsed_2l12 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 117.00 145.00 . . 15 . N . 15 . CA . 15 . C . 16 . N parsed_2l12 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -178.00 -58.00 . . 15 . C . 16 . N . 16 . CA . 16 . C parsed_2l12 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 98.00 170.00 . . 16 . N . 16 . CA . 16 . C . 17 . N parsed_2l12 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 42.00 66.00 . . 16 . C . 17 . N . 17 . CA . 17 . C parsed_2l12 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 27.00 51.00 . . 17 . N . 17 . CA . 17 . C . 18 . N parsed_2l12 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 60.00 92.00 . . 17 . C . 18 . N . 18 . CA . 18 . C parsed_2l12 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -17.00 27.00 . . 18 . N . 18 . CA . 18 . C . 19 . N parsed_2l12 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -131.90 -84.90 . . 18 . C . 19 . N . 19 . CA . 19 . C parsed_2l12 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 112.60 155.70 . . 19 . N . 19 . CA . 19 . C . 20 . N parsed_2l12 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -128.90 -71.00 . . 19 . C . 20 . N . 20 . CA . 20 . C parsed_2l12 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 111.40 148.40 . . 20 . N . 20 . CA . 20 . C . 21 . N parsed_2l12 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -167.70 -99.00 . . 20 . C . 21 . N . 21 . CA . 21 . C parsed_2l12 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 138.90 181.00 . . 21 . N . 21 . CA . 21 . C . 22 . N parsed_2l12 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -169.00 -85.00 . . 21 . C . 22 . N . 22 . CA . 22 . C parsed_2l12 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 108.00 164.00 . . 22 . N . 22 . CA . 22 . C . 23 . N parsed_2l12 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -129.00 -65.00 . . 23 . C . 24 . N . 24 . CA . 24 . C parsed_2l12 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 109.00 149.00 . . 24 . N . 24 . CA . 24 . C . 25 . N parsed_2l12 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -127.50 -70.40 . . 24 . C . 25 . N . 25 . CA . 25 . C parsed_2l12 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 103.20 139.50 . . 25 . N . 25 . CA . 25 . C . 26 . N parsed_2l12 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -139.00 -55.00 . . 25 . C . 26 . N . 26 . CA . 26 . C parsed_2l12 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 80.00 156.00 . . 26 . N . 26 . CA . 26 . C . 27 . N parsed_2l12 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -151.20 -51.50 . . 28 . C . 29 . N . 29 . CA . 29 . C parsed_2l12 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 70.60 177.90 . . 29 . N . 29 . CA . 29 . C . 30 . N parsed_2l12 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -46.00 . . 31 . C . 32 . N . 32 . CA . 32 . C parsed_2l12 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59.00 21.00 . . 32 . N . 32 . CA . 32 . C . 33 . N parsed_2l12 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -119.00 -63.00 . . 32 . C . 33 . N . 33 . CA . 33 . C parsed_2l12 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -30.00 22.00 . . 33 . N . 33 . CA . 33 . C . 34 . N parsed_2l12 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -158.50 -75.50 . . 34 . C . 35 . N . 35 . CA . 35 . C parsed_2l12 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 123.60 172.20 . . 35 . N . 35 . CA . 35 . C . 36 . N parsed_2l12 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -145.00 -85.00 . . 36 . C . 37 . N . 37 . CA . 37 . C parsed_2l12 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 84.00 196.00 . . 37 . N . 37 . CA . 37 . C . 38 . N parsed_2l12 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.00 -38.00 . . 38 . C . 39 . N . 39 . CA . 39 . C parsed_2l12 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -61.00 -9.00 . . 39 . N . 39 . CA . 39 . C . 40 . N parsed_2l12 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -82.10 -55.80 . . 39 . C . 40 . N . 40 . CA . 40 . C parsed_2l12 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -51.80 -2.20 . . 40 . N . 40 . CA . 40 . C . 41 . N parsed_2l12 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -70.00 . . 43 . C . 44 . N . 44 . CA . 44 . C parsed_2l12 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 78.00 182.00 . . 44 . N . 44 . CA . 44 . C . 45 . N parsed_2l12 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -50.00 . . 45 . C . 46 . N . 46 . CA . 46 . C parsed_2l12 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65.00 -17.00 . . 46 . N . 46 . CA . 46 . C . 47 . N parsed_2l12 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.00 -49.00 . . 46 . C . 47 . N . 47 . CA . 47 . C parsed_2l12 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.00 -28.00 . . 47 . N . 47 . CA . 47 . C . 48 . N parsed_2l12 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -89.10 -49.30 . . 47 . C . 48 . N . 48 . CA . 48 . C parsed_2l12 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53.00 -19.70 . . 48 . N . 48 . CA . 48 . C . 49 . N parsed_2l12 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.30 -49.70 . . 48 . C . 49 . N . 49 . CA . 49 . C parsed_2l12 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -53.50 -29.60 . . 49 . N . 49 . CA . 49 . C . 50 . N parsed_2l12 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -76.80 -51.30 . . 49 . C . 50 . N . 50 . CA . 50 . C parsed_2l12 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.30 -30.30 . . 50 . N . 50 . CA . 50 . C . 51 . N parsed_2l12 1
65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.00 -55.00 . . 50 . C . 51 . N . 51 . CA . 51 . C parsed_2l12 1
66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.00 -31.00 . . 51 . N . 51 . CA . 51 . C . 52 . N parsed_2l12 1
67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -102.50 -41.80 . . 51 . C . 52 . N . 52 . CA . 52 . C parsed_2l12 1
68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.10 -7.40 . . 52 . N . 52 . CA . 52 . C . 53 . N parsed_2l12 1
stop_
save_
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