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 |
|
|
599072 |
2n2v   |
25613 | cing | 2-parsed | STAR | dihedral angle | 50 |
data_2n2v_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2n2v
_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_2n2v 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2n2v
_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 2n2v "Master copy" parsed_2n2v
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2n2v
_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 2n2v.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2n2v 1
1 2n2v.mr . . XPLOR/CNS 2 distance NOE simple 884 parsed_2n2v 1
1 2n2v.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 26 parsed_2n2v 1
1 2n2v.mr . . XPLOR/CNS 4 distance "general distance" simple 10 parsed_2n2v 1
1 2n2v.mr . . XPLOR/CNS 5 distance "hydrogen bond" simple 26 parsed_2n2v 1
1 2n2v.mr . . XPLOR/CNS 6 "dihedral angle" "Not applicable" "Not applicable" 50 parsed_2n2v 1
1 2n2v.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2n2v 1
stop_
save_
save_CNS/XPLOR_dihedral_6
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2n2v
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 6
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.8 -34.4 . . 2 . C . 3 . N . 3 . CA . 3 . C parsed_2n2v 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -63.4 6.6 . . 3 . N . 3 . CA . 3 . C . 4 . N parsed_2n2v 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.1 -52.7 . . 3 . C . 4 . N . 4 . CA . 4 . C parsed_2n2v 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57.1 -7.7 . . 4 . N . 4 . CA . 4 . C . 5 . N parsed_2n2v 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -103.8 -49.2 . . 4 . C . 5 . N . 5 . CA . 5 . C parsed_2n2v 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54.6 22.8 . . 5 . N . 5 . CA . 5 . C . 6 . N parsed_2n2v 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.9 -43.3 . . 7 . C . 8 . N . 8 . CA . 8 . C parsed_2n2v 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -63.0 3.4 . . 8 . N . 8 . CA . 8 . C . 9 . N parsed_2n2v 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -192.3 -53.7 . . 8 . C . 9 . N . 9 . CA . 9 . C parsed_2n2v 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 87.6 184.6 . . 9 . N . 9 . CA . 9 . C . 10 . N parsed_2n2v 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -133.6 -89.0 . . 9 . C . 10 . N . 10 . CA . 10 . C parsed_2n2v 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 113.1 145.5 . . 10 . N . 10 . CA . 10 . C . 11 . N parsed_2n2v 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -137.0 -46.6 . . 11 . C . 12 . N . 12 . CA . 12 . C parsed_2n2v 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 146.1 188.3 . . 12 . N . 12 . CA . 12 . C . 13 . N parsed_2n2v 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.6 -49.2 . . 12 . C . 13 . N . 13 . CA . 13 . C parsed_2n2v 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -49.5 -22.9 . . 13 . N . 13 . CA . 13 . C . 14 . N parsed_2n2v 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.6 -56.2 . . 13 . C . 14 . N . 14 . CA . 14 . C parsed_2n2v 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -51.2 -26.8 . . 14 . N . 14 . CA . 14 . C . 15 . N parsed_2n2v 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.0 -51.4 . . 14 . C . 15 . N . 15 . CA . 15 . C parsed_2n2v 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58.2 -25.6 . . 15 . N . 15 . CA . 15 . C . 16 . N parsed_2n2v 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.8 -53.8 . . 15 . C . 16 . N . 16 . CA . 16 . C parsed_2n2v 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.6 -30.0 . . 16 . N . 16 . CA . 16 . C . 17 . N parsed_2n2v 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.5 -48.7 . . 16 . C . 17 . N . 17 . CA . 17 . C parsed_2n2v 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.8 -15.8 . . 17 . N . 17 . CA . 17 . C . 18 . N parsed_2n2v 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -123.4 -37.2 . . 17 . C . 18 . N . 18 . CA . 18 . C parsed_2n2v 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54.9 18.1 . . 18 . N . 18 . CA . 18 . C . 19 . N parsed_2n2v 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -117.2 -57.6 . . 20 . C . 21 . N . 21 . CA . 21 . C parsed_2n2v 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 90.5 168.1 . . 21 . N . 21 . CA . 21 . C . 22 . N parsed_2n2v 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -144.8 -48.4 . . 31 . C . 32 . N . 32 . CA . 32 . C parsed_2n2v 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 97.0 161.8 . . 32 . N . 32 . CA . 32 . C . 33 . N parsed_2n2v 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -178.1 -80.9 . . 35 . C . 36 . N . 36 . CA . 36 . C parsed_2n2v 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114.1 167.1 . . 36 . N . 36 . CA . 36 . C . 37 . N parsed_2n2v 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86.4 -40.0 . . 38 . C . 39 . N . 39 . CA . 39 . C parsed_2n2v 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59.8 11.6 . . 39 . N . 39 . CA . 39 . C . 40 . N parsed_2n2v 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.0 -53.6 . . 39 . C . 40 . N . 40 . CA . 40 . C parsed_2n2v 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -49.9 -19.9 . . 40 . N . 40 . CA . 40 . C . 41 . N parsed_2n2v 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.1 -50.5 . . 40 . C . 41 . N . 41 . CA . 41 . C parsed_2n2v 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58.1 -32.7 . . 41 . N . 41 . CA . 41 . C . 42 . N parsed_2n2v 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.3 -53.3 . . 41 . C . 42 . N . 42 . CA . 42 . C parsed_2n2v 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58.6 -29.6 . . 42 . N . 42 . CA . 42 . C . 43 . N parsed_2n2v 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.9 -55.9 . . 42 . C . 43 . N . 43 . CA . 43 . C parsed_2n2v 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -51.8 -23.2 . . 43 . N . 43 . CA . 43 . C . 44 . N parsed_2n2v 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.0 -53.0 . . 43 . C . 44 . N . 44 . CA . 44 . C parsed_2n2v 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.1 -30.9 . . 44 . N . 44 . CA . 44 . C . 45 . N parsed_2n2v 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -97.8 -37.8 . . 44 . C . 45 . N . 45 . CA . 45 . C parsed_2n2v 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.9 0.3 . . 45 . N . 45 . CA . 45 . C . 46 . N parsed_2n2v 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.7 -50.5 . . 45 . C . 46 . N . 46 . CA . 46 . C parsed_2n2v 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59.7 -17.3 . . 46 . N . 46 . CA . 46 . C . 47 . N parsed_2n2v 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.8 -51.0 . . 46 . C . 47 . N . 47 . CA . 47 . C parsed_2n2v 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.2 -25.4 . . 47 . N . 47 . CA . 47 . C . 48 . N parsed_2n2v 1
stop_
save_
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