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 |
|
|
39157 |
1sp7   |
6200 | cing | 2-parsed | STAR | dihedral angle | 15 |
data_1sp7_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1sp7
_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_1sp7 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1sp7
_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 1sp7 "Master copy" parsed_1sp7
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1sp7
_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 1sp7.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1sp7 1
1 1sp7.mr . . XPLOR/CNS 2 distance NOE simple 501 parsed_1sp7 1
1 1sp7.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 15 parsed_1sp7 1
1 1sp7.mr . . XPLOR/CNS 4 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_1sp7 1
1 1sp7.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1sp7 1
stop_
save_
save_CNS/XPLOR_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_1sp7
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -39.25 -5.87 . . 4 . N . 4 . CA . 4 . C . 5 . N parsed_1sp7 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -109.63 -62.27 . . 7 . C . 8 . N . 8 . CA . 8 . C parsed_1sp7 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.94 2.26 . . 8 . N . 8 . CA . 8 . C . 9 . N parsed_1sp7 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -44.15 -7.35 . . 12 . N . 12 . CA . 12 . C . 13 . N parsed_1sp7 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -112.40 -79.50 . . 12 . C . 13 . N . 13 . CA . 13 . C parsed_1sp7 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -20.61 13.89 . . 13 . N . 13 . CA . 13 . C . 14 . N parsed_1sp7 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.64 148.16 . . 15 . N . 15 . CA . 15 . C . 16 . N parsed_1sp7 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -76.79 -56.79 . . 15 . C . 16 . N . 16 . CA . 16 . C parsed_1sp7 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -47.40 -10.22 . . 16 . N . 16 . CA . 16 . C . 17 . N parsed_1sp7 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -99.68 -71.64 . . 16 . C . 17 . N . 17 . CA . 17 . C parsed_1sp7 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -29.50 27.90 . . 17 . N . 17 . CA . 17 . C . 18 . N parsed_1sp7 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 95.03 155.03 . . 20 . N . 20 . CA . 20 . C . 21 . N parsed_1sp7 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -106.36 -51.28 . . 20 . C . 21 . N . 21 . CA . 21 . C parsed_1sp7 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 2 . n . 2 . ca . 2 . cb . 2 . SG parsed_1sp7 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 9 . n . 9 . ca . 9 . cb . 9 . CG parsed_1sp7 1
stop_
save_
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