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 |
|
|
46611 |
2f09   |
6955 | cing | 2-parsed | STAR | dihedral angle | 36 |
data_2f09_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2f09
_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_2f09 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2f09
_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 2f09 "Master copy" parsed_2f09
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2f09
_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 2f09.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2f09 1
1 2f09.mr . . XPLOR/CNS 2 distance NOE simple 1303 parsed_2f09 1
1 2f09.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 36 parsed_2f09 1
1 2f09.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2f09 1
stop_
save_
save_CNS/XPLOR_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2f09
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -142.00 -74.00 . . 19 . C . 20 . N . 20 . CA . 20 . C parsed_2f09 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 81.00 165.00 . . 20 . N . 20 . CA . 20 . C . 21 . N parsed_2f09 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.00 -38.00 . . 20 . C . 21 . N . 21 . CA . 21 . C parsed_2f09 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.00 -16.00 . . 21 . N . 21 . CA . 21 . C . 22 . N parsed_2f09 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.00 -43.00 . . 21 . C . 22 . N . 22 . CA . 22 . C parsed_2f09 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -46.00 -6.00 . . 22 . N . 22 . CA . 22 . C . 23 . N parsed_2f09 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -163.00 -95.00 . . 24 . C . 25 . N . 25 . CA . 25 . C parsed_2f09 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 118.00 186.00 . . 25 . N . 25 . CA . 25 . C . 26 . N parsed_2f09 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -157.00 -105.00 . . 25 . C . 26 . N . 26 . CA . 26 . C parsed_2f09 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 125.00 165.00 . . 26 . N . 26 . CA . 26 . C . 27 . N parsed_2f09 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -156.00 -84.00 . . 26 . C . 27 . N . 27 . CA . 27 . C parsed_2f09 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114.00 170.00 . . 27 . N . 27 . CA . 27 . C . 28 . N parsed_2f09 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -191.00 -107.00 . . 27 . C . 28 . N . 28 . CA . 28 . C parsed_2f09 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 137.00 185.00 . . 28 . N . 28 . CA . 28 . C . 29 . N parsed_2f09 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -147.00 -75.00 . . 28 . C . 29 . N . 29 . CA . 29 . C parsed_2f09 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 111.00 151.00 . . 29 . N . 29 . CA . 29 . C . 30 . N parsed_2f09 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -148.00 -80.00 . . 55 . C . 56 . N . 56 . CA . 56 . C parsed_2f09 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 96.00 172.00 . . 56 . N . 56 . CA . 56 . C . 57 . N parsed_2f09 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -172.00 -72.00 . . 56 . C . 57 . N . 57 . CA . 57 . C parsed_2f09 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 99.00 171.00 . . 57 . N . 57 . CA . 57 . C . 58 . N parsed_2f09 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -167.00 -99.00 . . 60 . C . 61 . N . 61 . CA . 61 . C parsed_2f09 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 123.00 175.00 . . 61 . N . 61 . CA . 61 . C . 62 . N parsed_2f09 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -168.00 -120.00 . . 61 . C . 62 . N . 62 . CA . 62 . C parsed_2f09 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.00 160.00 . . 62 . N . 62 . CA . 62 . C . 63 . N parsed_2f09 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.00 -94.00 . . 62 . C . 63 . N . 63 . CA . 63 . C parsed_2f09 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 107.00 163.00 . . 63 . N . 63 . CA . 63 . C . 64 . N parsed_2f09 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -161.00 -77.00 . . 64 . C . 65 . N . 65 . CA . 65 . C parsed_2f09 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 105.00 189.00 . . 65 . N . 65 . CA . 65 . C . 66 . N parsed_2f09 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -145.00 -49.00 . . 65 . C . 66 . N . 66 . CA . 66 . C parsed_2f09 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 97.00 169.00 . . 66 . N . 66 . CA . 66 . C . 67 . N parsed_2f09 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -159.00 -107.00 . . 74 . C . 75 . N . 75 . CA . 75 . C parsed_2f09 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 119.00 191.00 . . 75 . N . 75 . CA . 75 . C . 76 . N parsed_2f09 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -153.00 -85.00 . . 75 . C . 76 . N . 76 . CA . 76 . C parsed_2f09 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 104.00 148.00 . . 76 . N . 76 . CA . 76 . C . 77 . N parsed_2f09 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -88.00 -48.00 . . 76 . C . 77 . N . 77 . CA . 77 . C parsed_2f09 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 117.00 157.00 . . 77 . N . 77 . CA . 77 . C . 78 . N parsed_2f09 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 "N 20 Phi Psi" 1 1 1 16 parsed_2f09 1
2 "N 21 Phi Psi" 6 1 6 16 parsed_2f09 1
3 "P 22 Phi Psi" 11 1 11 16 parsed_2f09 1
4 "E 25 Phi Psi" 16 1 16 16 parsed_2f09 1
5 "V 26 Phi Psi" 21 1 21 16 parsed_2f09 1
6 "S 27 Phi Psi" 26 1 26 16 parsed_2f09 1
7 "F 28 Phi Psi" 31 1 31 16 parsed_2f09 1
8 "V 29 Phi Psi" 36 1 36 16 parsed_2f09 1
9 "W 56 Phi Psi" 41 1 41 16 parsed_2f09 1
10 "S 57 Phi Psi" 46 1 46 16 parsed_2f09 1
11 "E 61 Phi Psi" 51 1 51 16 parsed_2f09 1
12 "A 62 Phi Psi" 56 1 56 16 parsed_2f09 1
13 "T 63 Phi Psi" 61 1 61 16 parsed_2f09 1
14 "Y 65 Phi Psi" 66 1 66 16 parsed_2f09 1
15 "K 66 Phi Psi" 71 1 71 16 parsed_2f09 1
16 "C 75 Phi Psi" 76 1 76 16 parsed_2f09 1
17 "Q 76 Phi Psi" 81 1 81 16 parsed_2f09 1
18 "L 77 Phi Psi" 86 1 86 16 parsed_2f09 1
stop_
save_
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