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 | subtype | subsubtype | item_count |
|
|
476176 |
1kr8   |
5282 | cing | 2-parsed | STAR | distance | NOE | simple | 10 |
data_1kr8_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1kr8
_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_1kr8 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1kr8
_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 1kr8 "Master copy" parsed_1kr8
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1kr8
_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 1kr8.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1kr8 1
1 1kr8.mr . . AMBER 2 distance NOE simple 10 parsed_1kr8 1
1 1kr8.mr . . AMBER 3 distance NOE simple 89 parsed_1kr8 1
1 1kr8.mr . . AMBER 4 "dihedral angle" "Not applicable" "Not applicable" 37 parsed_1kr8 1
1 1kr8.mr . . AMBER 5 distance NOE simple 10 parsed_1kr8 1
1 1kr8.mr . . n/a 6 comment "Not applicable" "Not applicable" 0 parsed_1kr8 1
1 1kr8.mr . . AMBER 7 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_1kr8 1
1 1kr8.mr . . n/a 8 comment "Not applicable" "Not applicable" 0 parsed_1kr8 1
1 1kr8.mr . . "MR format" 9 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1kr8 1
stop_
save_
save_AMBER_distance_constraints_5
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1kr8
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 5
_Distance_constraint_list.Details "Generated by Wattos"
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . parsed_1kr8 1
2 1 . . . parsed_1kr8 1
3 1 . . . parsed_1kr8 1
4 1 . . . parsed_1kr8 1
5 1 . . . parsed_1kr8 1
6 1 . . . parsed_1kr8 1
7 1 . . . parsed_1kr8 1
8 1 . . . parsed_1kr8 1
9 1 . . . parsed_1kr8 1
10 1 . . . parsed_1kr8 1
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Assembly_atom_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Seq_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Resonance_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 . . . . . . . . 1kr8_ambr001 6 G H1' parsed_1kr8 1
1 1 2 . . . . . . . . 1kr8_ambr001 5 A H2 parsed_1kr8 1
2 1 1 . . . . . . . . 1kr8_ambr001 4 A H1' parsed_1kr8 1
2 1 2 . . . . . . . . 1kr8_ambr001 4 A H2 parsed_1kr8 1
3 1 1 . . . . . . . . 1kr8_ambr001 5 A H1' parsed_1kr8 1
3 1 2 . . . . . . . . 1kr8_ambr001 5 A H2 parsed_1kr8 1
4 1 1 . . . . . . . . 1kr8_ambr001 4 A H4' parsed_1kr8 1
4 1 2 . . . . . . . . 1kr8_ambr001 5 A H2 parsed_1kr8 1
5 1 1 . . . . . . . . 1kr8_ambr001 3 G H4' parsed_1kr8 1
5 1 2 . . . . . . . . 1kr8_ambr001 5 A H2 parsed_1kr8 1
6 1 1 . . . . . . . . 1kr8_ambr001 4 A H5'1 parsed_1kr8 1
6 1 1 . . . . . . . . 1kr8_ambr001 4 A H5'2 parsed_1kr8 1
6 1 2 . . . . . . . . 1kr8_ambr001 5 A H2 parsed_1kr8 1
7 1 1 . . . . . . . . 1kr8_ambr001 4 A H5'1 parsed_1kr8 1
7 1 1 . . . . . . . . 1kr8_ambr001 4 A H5'2 parsed_1kr8 1
7 1 2 . . . . . . . . 1kr8_ambr001 5 A H2 parsed_1kr8 1
8 1 1 . . . . . . . . 1kr8_ambr001 5 A H5'1 parsed_1kr8 1
8 1 1 . . . . . . . . 1kr8_ambr001 5 A H5'2 parsed_1kr8 1
8 1 2 . . . . . . . . 1kr8_ambr001 5 A H8 parsed_1kr8 1
9 1 1 . . . . . . . . 1kr8_ambr001 5 A H5'1 parsed_1kr8 1
9 1 1 . . . . . . . . 1kr8_ambr001 5 A H5'2 parsed_1kr8 1
9 1 2 . . . . . . . . 1kr8_ambr001 5 A H8 parsed_1kr8 1
10 1 1 . . . . . . . . 1kr8_ambr001 4 A H5'1 parsed_1kr8 1
10 1 1 . . . . . . . . 1kr8_ambr001 4 A H5'2 parsed_1kr8 1
10 1 2 . . . . . . . . 1kr8_ambr001 3 G H1' parsed_1kr8 1
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 7.39 4.22 7.89 parsed_1kr8 1
2 1 . . . . . 6.21 3.55 6.71 parsed_1kr8 1
3 1 . . . . . 7.34 4.19 7.84 parsed_1kr8 1
4 1 . . . . . 6.64 3.79 7.14 parsed_1kr8 1
5 1 . . . . . 7.44 4.25 7.94 parsed_1kr8 1
6 1 . . . . . 6.82 3.47 7.32 parsed_1kr8 1
7 1 . . . . . 7.77 3.96 8.27 parsed_1kr8 1
8 1 . . . . . 5.29 2.69 5.79 parsed_1kr8 1
9 1 . . . . . 6.50 3.31 7.00 parsed_1kr8 1
10 1 . . . . . 4.87 2.48 5.37 parsed_1kr8 1
stop_
loop_
_Dist_constraint_comment_org.ID
_Dist_constraint_comment_org.Comment_text
_Dist_constraint_comment_org.Comment_begin_line
_Dist_constraint_comment_org.Comment_begin_column
_Dist_constraint_comment_org.Comment_end_line
_Dist_constraint_comment_org.Comment_end_column
_Dist_constraint_comment_org.Entry_ID
_Dist_constraint_comment_org.Distance_constraint_list_ID
1
;
additional NOE distances
6 DG H1' 5 DA H2 4.224 7.391
;
1 1 2 46 parsed_1kr8 1
2 "4 DA H1' 4 DA H2 3.550 6.213" 7 1 8 46 parsed_1kr8 1
3 "5 DA H1' 5 DA H2 4.194 7.340" 11 1 12 46 parsed_1kr8 1
4 "4 DA H4' 5 DA H2 3.793 6.638" 15 1 16 46 parsed_1kr8 1
5 "3 DG H4' 5 DA H2 4.253 7.443" 19 1 20 46 parsed_1kr8 1
6 "4 DA Q5' 5 DA H2 3.470 6.072" 23 1 24 46 parsed_1kr8 1
7 "4 DA Q5' 5 DA H2 3.956 6.923" 29 1 30 46 parsed_1kr8 1
8 "5 DA Q5' 5 DA H8 2.695 4.716" 35 1 36 46 parsed_1kr8 1
9 "5 DA Q5' 5 DA H8 3.308 5.789" 41 1 42 46 parsed_1kr8 1
10 "4 DA Q5' 3 DG H1' 2.481 4.342" 47 1 48 46 parsed_1kr8 1
stop_
save_
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