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 |
|
|
549750 |
2lug   |
18520 | cing | 2-parsed | STAR | dihedral angle | 28 |
data_2lug_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2lug
_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_2lug 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2lug
_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 2lug "Master copy" parsed_2lug
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2lug
_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 2lug.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2lug 1
1 2lug.mr . . NMRPipe 2 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_2lug 1
1 2lug.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 28 parsed_2lug 1
1 2lug.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2lug 1
stop_
save_
save_CNS/XPLOR_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2lug
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77 -37 . . 10 . C . 11 . N . 11 . CA . 11 . C parsed_2lug 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -44 . . 11 . C . 12 . N . 12 . CA . 12 . C parsed_2lug 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75 -51 . . 12 . C . 13 . N . 13 . CA . 13 . C parsed_2lug 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72 -48 . . 13 . C . 14 . N . 14 . CA . 14 . C parsed_2lug 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74 -54 . . 14 . C . 15 . N . 15 . CA . 15 . C parsed_2lug 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -76 -52 . . 15 . C . 16 . N . 16 . CA . 16 . C parsed_2lug 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -69 -49 . . 16 . C . 17 . N . 17 . CA . 17 . C parsed_2lug 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83 -55 . . 17 . C . 18 . N . 18 . CA . 18 . C parsed_2lug 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86 -50 . . 18 . C . 19 . N . 19 . CA . 19 . C parsed_2lug 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -133 -57 . . 19 . C . 20 . N . 20 . CA . 20 . C parsed_2lug 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -91 -43 . . 21 . C . 22 . N . 22 . CA . 22 . C parsed_2lug 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -93 -49 . . 24 . C . 25 . N . 25 . CA . 25 . C parsed_2lug 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -56 . . 25 . C . 26 . N . 26 . CA . 26 . C parsed_2lug 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86 -54 . . 26 . C . 27 . N . 27 . CA . 27 . C parsed_2lug 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50 -14 . . 11 . N . 11 . CA . 11 . C . 12 . N parsed_2lug 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60 -20 . . 12 . N . 12 . CA . 12 . C . 13 . N parsed_2lug 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56 -36 . . 13 . N . 13 . CA . 13 . C . 14 . N parsed_2lug 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -45 -29 . . 14 . N . 14 . CA . 14 . C . 15 . N parsed_2lug 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58 -34 . . 15 . N . 15 . CA . 15 . C . 16 . N parsed_2lug 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -68 -12 . . 16 . N . 16 . CA . 16 . C . 17 . N parsed_2lug 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60 -20 . . 17 . N . 17 . CA . 17 . C . 18 . N parsed_2lug 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -47 -11 . . 18 . N . 18 . CA . 18 . C . 19 . N parsed_2lug 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54 -22 . . 19 . N . 19 . CA . 19 . C . 20 . N parsed_2lug 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -37 19 . . 20 . N . 20 . CA . 20 . C . 21 . N parsed_2lug 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 128 172 . . 22 . N . 22 . CA . 22 . C . 23 . N parsed_2lug 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 130 162 . . 25 . N . 25 . CA . 25 . C . 26 . N parsed_2lug 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 135 175 . . 26 . N . 26 . CA . 26 . C . 27 . N parsed_2lug 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 134 170 . . 27 . N . 27 . CA . 27 . C . 28 . N parsed_2lug 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 "Talos derived phi restraint:" 1 1 1 31 parsed_2lug 1
2 "Talos derived phi restraint:" 8 1 8 31 parsed_2lug 1
3 "Talos derived phi restraint:" 15 1 15 31 parsed_2lug 1
4 "Talos derived phi restraint:" 22 1 22 31 parsed_2lug 1
5 "Talos derived phi restraint:" 29 1 29 31 parsed_2lug 1
6 "Talos derived phi restraint:" 36 1 36 31 parsed_2lug 1
7 "Talos derived phi restraint:" 43 1 43 31 parsed_2lug 1
8 "Talos derived phi restraint:" 50 1 50 31 parsed_2lug 1
9 "Talos derived phi restraint:" 57 1 57 31 parsed_2lug 1
10 "Talos derived phi restraint:" 64 1 64 31 parsed_2lug 1
11 "Talos derived phi restraint:" 71 1 71 31 parsed_2lug 1
12 "Talos derived phi restraint:" 78 1 78 31 parsed_2lug 1
13 "Talos derived phi restraint:" 85 1 85 31 parsed_2lug 1
14 "Talos derived phi restraint:" 92 1 92 31 parsed_2lug 1
15 "Talos derived psi restraint:" 99 1 99 31 parsed_2lug 1
16 "Talos derived psi restraint:" 106 1 106 31 parsed_2lug 1
17 "Talos derived psi restraint:" 113 1 113 31 parsed_2lug 1
18 "Talos derived psi restraint:" 120 1 120 31 parsed_2lug 1
19 "Talos derived psi restraint:" 127 1 127 31 parsed_2lug 1
20 "Talos derived psi restraint:" 134 1 134 31 parsed_2lug 1
21 "Talos derived psi restraint:" 141 1 141 31 parsed_2lug 1
22 "Talos derived psi restraint:" 148 1 148 31 parsed_2lug 1
23 "Talos derived psi restraint:" 155 1 155 31 parsed_2lug 1
24 "Talos derived psi restraint:" 162 1 162 31 parsed_2lug 1
25 "Talos derived psi restraint:" 169 1 169 31 parsed_2lug 1
26 "Talos derived psi restraint:" 176 1 176 31 parsed_2lug 1
27 "Talos derived psi restraint:" 183 1 183 31 parsed_2lug 1
28 "Talos derived psi restraint:" 190 1 190 31 parsed_2lug 1
stop_
save_
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