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 |
|
|
48844 |
2jor   |
15192 | cing | 2-parsed | STAR | dihedral angle | 50 |
data_2jor_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2jor
_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_2jor 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2jor
_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 2jor "Master copy" parsed_2jor
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2jor
_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 2jor.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2jor 1
1 2jor.mr . . XPLOR/CNS 2 distance NOE simple 299 parsed_2jor 1
1 2jor.mr . . XPLOR/CNS 3 "dipolar coupling" "Not applicable" "Not applicable" 32 parsed_2jor 1
1 2jor.mr . . XPLOR/CNS 4 "dipolar coupling" "Not applicable" "Not applicable" 39 parsed_2jor 1
1 2jor.mr . . XPLOR/CNS 5 distance "hydrogen bond" simple 22 parsed_2jor 1
1 2jor.mr . . XPLOR/CNS 6 "dihedral angle" "Not applicable" "Not applicable" 50 parsed_2jor 1
1 2jor.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2jor 1
stop_
save_
save_CNS/XPLOR_dihedral_6
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2jor
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -143.58 -90.00 . . 14 . C . 15 . N . 15 . CA . 15 . C parsed_2jor 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -152.18 -115.36 . . 15 . C . 16 . N . 16 . CA . 16 . C parsed_2jor 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -145.90 -125.90 . . 18 . C . 19 . N . 19 . CA . 19 . C parsed_2jor 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -122.07 -65.77 . . 19 . C . 20 . N . 20 . CA . 20 . C parsed_2jor 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -147.50 -74.98 . . 20 . C . 21 . N . 21 . CA . 21 . C parsed_2jor 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -118.37 -82.75 . . 21 . C . 22 . N . 22 . CA . 22 . C parsed_2jor 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -123.86 -93.94 . . 22 . C . 23 . N . 23 . CA . 23 . C parsed_2jor 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -122.23 -96.13 . . 23 . C . 24 . N . 24 . CA . 24 . C parsed_2jor 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -112.03 -92.03 . . 24 . C . 25 . N . 25 . CA . 25 . C parsed_2jor 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -121.56 -98.20 . . 25 . C . 26 . N . 26 . CA . 26 . C parsed_2jor 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -128.29 -106.81 . . 26 . C . 27 . N . 27 . CA . 27 . C parsed_2jor 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -104.90 -82.24 . . 27 . C . 28 . N . 28 . CA . 28 . C parsed_2jor 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -111.01 -59.09 . . 28 . C . 29 . N . 29 . CA . 29 . C parsed_2jor 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -69.83 -49.83 . . 29 . C . 30 . N . 30 . CA . 30 . C parsed_2jor 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -96.05 -76.05 . . 30 . C . 31 . N . 31 . CA . 31 . C parsed_2jor 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 82.91 102.91 . . 31 . C . 32 . N . 32 . CA . 32 . C parsed_2jor 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -146.59 -67.19 . . 32 . C . 33 . N . 33 . CA . 33 . C parsed_2jor 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -157.03 -86.91 . . 33 . C . 34 . N . 34 . CA . 34 . C parsed_2jor 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -118.52 -80.32 . . 34 . C . 35 . N . 35 . CA . 35 . C parsed_2jor 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -129.05 -100.37 . . 35 . C . 36 . N . 36 . CA . 36 . C parsed_2jor 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -121.48 -77.28 . . 39 . C . 40 . N . 40 . CA . 40 . C parsed_2jor 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -126.85 -99.47 . . 40 . C . 41 . N . 41 . CA . 41 . C parsed_2jor 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -115.77 -59.45 . . 41 . C . 42 . N . 42 . CA . 42 . C parsed_2jor 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -137.92 -117.92 . . 48 . C . 49 . N . 49 . CA . 49 . C parsed_2jor 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.00 -70.22 . . 59 . C . 60 . N . 60 . CA . 60 . C parsed_2jor 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 129.84 157.80 . . 15 . N . 15 . CA . 15 . C . 16 . N parsed_2jor 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 136.55 164.59 . . 16 . N . 16 . CA . 16 . C . 17 . N parsed_2jor 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 145.61 174.81 . . 19 . N . 19 . CA . 19 . C . 20 . N parsed_2jor 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 121.70 152.68 . . 20 . N . 20 . CA . 20 . C . 21 . N parsed_2jor 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 112.11 161.31 . . 21 . N . 21 . CA . 21 . C . 22 . N parsed_2jor 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 122.16 149.64 . . 22 . N . 22 . CA . 22 . C . 23 . N parsed_2jor 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 113.51 157.11 . . 23 . N . 23 . CA . 23 . C . 24 . N parsed_2jor 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 115.03 136.05 . . 24 . N . 24 . CA . 24 . C . 25 . N parsed_2jor 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114.23 147.05 . . 25 . N . 25 . CA . 25 . C . 26 . N parsed_2jor 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 119.81 139.81 . . 26 . N . 26 . CA . 26 . C . 27 . N parsed_2jor 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 115.40 153.12 . . 27 . N . 27 . CA . 27 . C . 28 . N parsed_2jor 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110.02 132.78 . . 28 . N . 28 . CA . 28 . C . 29 . N parsed_2jor 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 116.17 173.43 . . 29 . N . 29 . CA . 29 . C . 30 . N parsed_2jor 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -38.09 -18.09 . . 30 . N . 30 . CA . 30 . C . 31 . N parsed_2jor 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -10.49 9.51 . . 31 . N . 31 . CA . 31 . C . 32 . N parsed_2jor 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -13.65 6.35 . . 32 . N . 32 . CA . 32 . C . 33 . N parsed_2jor 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.3 162.5 . . 33 . N . 33 . CA . 33 . C . 34 . N parsed_2jor 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 113.8 148.6 . . 34 . N . 34 . CA . 34 . C . 35 . N parsed_2jor 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.12 150.38 . . 35 . N . 35 . CA . 35 . C . 36 . N parsed_2jor 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114.19 136.81 . . 36 . N . 36 . CA . 36 . C . 37 . N parsed_2jor 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 119.65 144.41 . . 40 . N . 40 . CA . 40 . C . 41 . N parsed_2jor 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 116.70 153.94 . . 41 . N . 41 . CA . 41 . C . 42 . N parsed_2jor 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 117.21 151.17 . . 42 . N . 42 . CA . 42 . C . 43 . N parsed_2jor 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 143.21 168.37 . . 49 . N . 49 . CA . 49 . C . 50 . N parsed_2jor 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114.61 154.73 . . 60 . N . 60 . CA . 60 . C . 61 . N parsed_2jor 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 new 65 1 65 5 parsed_2jor 1
2 new 81 1 81 5 parsed_2jor 1
3 new 87 1 87 5 parsed_2jor 1
4 new 193 1 193 5 parsed_2jor 1
5 new 214 1 214 5 parsed_2jor 1
6 new 220 1 220 5 parsed_2jor 1
stop_
save_
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