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 |
|
|
576113 |
2m2l   |
18920 | cing | 2-parsed | STAR | dihedral angle | 61 |
data_2m2l_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2m2l
_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_2m2l 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2m2l
_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 2m2l "Master copy" parsed_2m2l
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2m2l
_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 2m2l.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2m2l 1
1 2m2l.mr . . XPLOR/CNS 2 distance NOE simple 1847 parsed_2m2l 1
1 2m2l.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 61 parsed_2m2l 1
1 2m2l.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2m2l 1
stop_
save_
save_CNS/XPLOR_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2m2l
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -172.5 -93.3 . . 16 . C . 17 . N . 17 . CA . 17 . C parsed_2m2l 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 124.2 188.0 . . 17 . N . 17 . CA . 17 . C . 18 . N parsed_2m2l 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.5 -53.9 . . 17 . C . 18 . N . 18 . CA . 18 . C parsed_2m2l 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 93.8 150.2 . . 18 . N . 18 . CA . 18 . C . 19 . N parsed_2m2l 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -128.4 -60.4 . . 18 . C . 19 . N . 19 . CA . 19 . C parsed_2m2l 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.0 -0.8 . . 19 . N . 19 . CA . 19 . C . 20 . N parsed_2m2l 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -189.9 -112.9 . . 19 . C . 20 . N . 20 . CA . 20 . C parsed_2m2l 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 116.4 191.2 . . 20 . N . 20 . CA . 20 . C . 21 . N parsed_2m2l 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -159.5 -99.5 . . 20 . C . 21 . N . 21 . CA . 21 . C parsed_2m2l 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 111.5 169.1 . . 21 . N . 21 . CA . 21 . C . 22 . N parsed_2m2l 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -169.4 -90.4 . . 21 . C . 22 . N . 22 . CA . 22 . C parsed_2m2l 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 111.4 174.6 . . 22 . N . 22 . CA . 22 . C . 23 . N parsed_2m2l 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.4 -71.2 . . 22 . C . 23 . N . 23 . CA . 23 . C parsed_2m2l 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 102.8 150.2 . . 23 . N . 23 . CA . 23 . C . 24 . N parsed_2m2l 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -159.5 -97.5 . . 23 . C . 24 . N . 24 . CA . 24 . C parsed_2m2l 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 102.2 142.2 . . 24 . N . 24 . CA . 24 . C . 25 . N parsed_2m2l 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -124.5 -59.5 . . 26 . C . 27 . N . 27 . CA . 27 . C parsed_2m2l 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 105.9 148.5 . . 27 . N . 27 . CA . 27 . C . 28 . N parsed_2m2l 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -127.7 -67.3 . . 27 . C . 28 . N . 28 . CA . 28 . C parsed_2m2l 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 105.9 151.9 . . 28 . N . 28 . CA . 28 . C . 29 . N parsed_2m2l 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -168.9 -90.9 . . 28 . C . 29 . N . 29 . CA . 29 . C parsed_2m2l 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 121.3 188.5 . . 29 . N . 29 . CA . 29 . C . 30 . N parsed_2m2l 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -136.4 -82.8 . . 30 . C . 31 . N . 31 . CA . 31 . C parsed_2m2l 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 71.5 156.5 . . 31 . N . 31 . CA . 31 . C . 32 . N parsed_2m2l 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -156.4 -60.6 . . 31 . C . 32 . N . 32 . CA . 32 . C parsed_2m2l 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 87.1 185.9 . . 32 . N . 32 . CA . 32 . C . 33 . N parsed_2m2l 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -153.7 -87.3 . . 42 . C . 43 . N . 43 . CA . 43 . C parsed_2m2l 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 137.4 177.4 . . 43 . N . 43 . CA . 43 . C . 44 . N parsed_2m2l 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -124.6 -65.8 . . 43 . C . 44 . N . 44 . CA . 44 . C parsed_2m2l 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 101.3 163.7 . . 44 . N . 44 . CA . 44 . C . 45 . N parsed_2m2l 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -153.9 -97.7 . . 44 . C . 45 . N . 45 . CA . 45 . C parsed_2m2l 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 126.9 191.5 . . 45 . N . 45 . CA . 45 . C . 46 . N parsed_2m2l 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.6 -38.6 . . 46 . C . 47 . N . 47 . CA . 47 . C parsed_2m2l 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59.1 -19.1 . . 47 . N . 47 . CA . 47 . C . 48 . N parsed_2m2l 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -96.0 -50.8 . . 49 . C . 50 . N . 50 . CA . 50 . C parsed_2m2l 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -51.4 -11.4 . . 50 . N . 50 . CA . 50 . C . 51 . N parsed_2m2l 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.2 -40.2 . . 50 . C . 51 . N . 51 . CA . 51 . C parsed_2m2l 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65.1 -19.9 . . 51 . N . 51 . CA . 51 . C . 52 . N parsed_2m2l 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -87.6 -47.6 . . 51 . C . 52 . N . 52 . CA . 52 . C parsed_2m2l 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57.1 -17.1 . . 52 . N . 52 . CA . 52 . C . 53 . N parsed_2m2l 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.9 -46.5 . . 52 . C . 53 . N . 53 . CA . 53 . C parsed_2m2l 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.1 10.5 . . 53 . N . 53 . CA . 53 . C . 54 . N parsed_2m2l 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.9 -49.9 . . 53 . C . 54 . N . 54 . CA . 54 . C parsed_2m2l 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -35.6 55.4 . . 54 . N . 54 . CA . 54 . C . 55 . N parsed_2m2l 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.5 -40.5 . . 54 . C . 55 . N . 55 . CA . 55 . C parsed_2m2l 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59.8 -19.8 . . 55 . N . 55 . CA . 55 . C . 56 . N parsed_2m2l 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.7 -40.7 . . 55 . C . 56 . N . 56 . CA . 56 . C parsed_2m2l 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -63.6 -23.6 . . 56 . N . 56 . CA . 56 . C . 57 . N parsed_2m2l 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -82.4 -42.4 . . 56 . C . 57 . N . 57 . CA . 57 . C parsed_2m2l 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -64.4 -24.4 . . 57 . N . 57 . CA . 57 . C . 58 . N parsed_2m2l 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86.1 -46.1 . . 57 . C . 58 . N . 58 . CA . 58 . C parsed_2m2l 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -64.7 -24.7 . . 58 . N . 58 . CA . 58 . C . 59 . N parsed_2m2l 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.9 -38.9 . . 58 . C . 59 . N . 59 . CA . 59 . C parsed_2m2l 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.0 -45.0 . . 61 . C . 62 . N . 62 . CA . 62 . C parsed_2m2l 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59.6 -15.6 . . 62 . N . 62 . CA . 62 . C . 63 . N parsed_2m2l 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.7 -48.7 . . 62 . C . 63 . N . 63 . CA . 63 . C parsed_2m2l 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.3 -2.3 . . 63 . N . 63 . CA . 63 . C . 64 . N parsed_2m2l 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -114.9 -49.1 . . 63 . C . 64 . N . 64 . CA . 64 . C parsed_2m2l 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65.6 17.8 . . 64 . N . 64 . CA . 64 . C . 65 . N parsed_2m2l 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -144.4 -66.6 . . 64 . C . 65 . N . 65 . CA . 65 . C parsed_2m2l 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -31.4 42.0 . . 65 . N . 65 . CA . 65 . C . 66 . N parsed_2m2l 1
stop_
save_
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