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 |
|
|
49536 |
2ju4   |
15430 | cing | 2-parsed | STAR | dihedral angle | 29 |
data_2ju4_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2ju4
_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_2ju4 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2ju4
_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 2ju4 "Master copy" parsed_2ju4
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2ju4
_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 2ju4.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2ju4 1
1 2ju4.mr . . XPLOR/CNS 2 distance "general distance" simple 651 parsed_2ju4 1
1 2ju4.mr . . XPLOR/CNS 3 distance NOE simple 494 parsed_2ju4 1
1 2ju4.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 29 parsed_2ju4 1
1 2ju4.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2ju4 1
stop_
save_
save_CNS/XPLOR_dihedral_4
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2ju4
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 4
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -129.300 -49.450 . " " 3 . c " " 4 . n " " 4 . ca " " 4 . c parsed_2ju4 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 115.75 178.79 . " " 4 . n " " 4 . ca " " 4 . c " " 5 . n parsed_2ju4 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 86.87 186.31 . " " 5 . n " " 5 . ca " " 5 . c " " 6 . n parsed_2ju4 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130.82 164.78 . " " 6 . n " " 6 . ca " " 6 . c " " 7 . n parsed_2ju4 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -137.400 -62.370 . " " 20 . c " " 21 . n " " 21 . ca " " 21 . c parsed_2ju4 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 96.81 163.89 . " " 21 . n " " 21 . ca " " 21 . c " " 22 . n parsed_2ju4 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -142.90 -52.74 . " " 21 . c " " 22 . n " " 22 . ca " " 22 . c parsed_2ju4 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 98.45 181.13 . " " 22 . n " " 22 . ca " " 22 . c " " 23 . n parsed_2ju4 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 122.08 181.12 . " " 27 . n " " 27 . ca " " 27 . c " " 28 . n parsed_2ju4 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 129.74 165.06 . " " 28 . n " " 28 . ca " " 28 . c " " 29 . n parsed_2ju4 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -147.300 -38.130 . " " 40 . c " " 41 . n " " 41 . ca " " 41 . c parsed_2ju4 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 83.45 192.93 . " " 41 . n " " 41 . ca " " 41 . c " " 42 . n parsed_2ju4 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 152.570 178.620 . " " 42 . n " " 42 . ca " " 42 . c " " 43 . n parsed_2ju4 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 123.33 164.85 . " " 43 . n " " 43 . ca " " 43 . c " " 44 . n parsed_2ju4 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -151.400 -46.550 . " " 53 . c " " 54 . n " " 54 . ca " " 54 . c parsed_2ju4 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 79.780 186.730 . " " 54 . n " " 54 . ca " " 54 . c " " 55 . n parsed_2ju4 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70 -50 . " " 62 . c " " 63 . n " " 63 . ca " " 63 . c parsed_2ju4 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -134.300 -68.130 . " " 66 . c " " 67 . n " " 67 . ca " " 67 . c parsed_2ju4 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 91.73 160.21 . " " 67 . n " " 67 . ca " " 67 . c " " 68 . n parsed_2ju4 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -122.90 -66.14 . " " 67 . c " " 68 . n " " 68 . ca " " 68 . c parsed_2ju4 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 66.43 176.67 . " " 68 . n " " 68 . ca " " 68 . c " " 69 . n parsed_2ju4 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -60 . " " 69 . c " " 70 . n " " 70 . ca " " 70 . c parsed_2ju4 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77 -57 . " " 71 . c " " 72 . n " " 72 . ca " " 72 . c parsed_2ju4 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -50 . " " 72 . c " " 73 . n " " 73 . ca " " 73 . c parsed_2ju4 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72 -52 . " " 76 . c " " 77 . n " " 77 . ca " " 77 . c parsed_2ju4 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -99.70 -51.58 . " " 80 . c " " 81 . n " " 81 . ca " " 81 . c parsed_2ju4 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -68.25 24.71 . " " 81 . n " " 81 . ca " " 81 . c " " 82 . n parsed_2ju4 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -68 -48 . " " 81 . c " " 82 . n " " 82 . ca " " 82 . c parsed_2ju4 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.39 -54.83 . " " 86 . c " " 87 . n " " 87 . ca " " 87 . c parsed_2ju4 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 "Dihedral Angle Restraints" 1 1 1 27 parsed_2ju4 1
stop_
save_
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