NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype | item_count |
|
|
641581 |
6qtf   |
34363 | cing | 2-parsed | STAR | distance | NOE | simple | 18 |
data_6qtf_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_6qtf
_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_6qtf 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_6qtf
_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 6qtf "Master copy" parsed_6qtf
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_6qtf
_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 6qtf.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_6qtf 1
1 6qtf.mr . . XPLOR/CNS 2 distance NOE simple 18 parsed_6qtf 1
1 6qtf.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_6qtf 1
1 6qtf.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_6qtf 1
stop_
save_
save_CNS/XPLOR_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_6qtf
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 2
_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_6qtf 1
2 1 . . . parsed_6qtf 1
3 1 . . . parsed_6qtf 1
4 1 . . . parsed_6qtf 1
5 1 . . . parsed_6qtf 1
6 1 . . . parsed_6qtf 1
7 1 . . . parsed_6qtf 1
8 1 . . . parsed_6qtf 1
9 1 . . . parsed_6qtf 1
10 1 . . . parsed_6qtf 1
11 1 . . . parsed_6qtf 1
12 1 . . . parsed_6qtf 1
13 1 . . . parsed_6qtf 1
14 1 . . . parsed_6qtf 1
15 1 . . . parsed_6qtf 1
16 1 . . . parsed_6qtf 1
17 1 . . . parsed_6qtf 1
18 1 . . . parsed_6qtf 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 . . . . . . . . . 2 . HA parsed_6qtf 1
1 1 2 . . . . . . . . . 3 . HN parsed_6qtf 1
2 1 1 . . . . . . . . . 4 . HN parsed_6qtf 1
2 1 2 . . . . . . . . . 3 . HN parsed_6qtf 1
3 1 1 . . . . . . . . . 5 . HN parsed_6qtf 1
3 1 2 . . . . . . . . . 4 . HN parsed_6qtf 1
4 1 1 . . . . . . . . . 4 . HB1 parsed_6qtf 1
4 1 2 . . . . . . . . . 5 . HN parsed_6qtf 1
5 1 1 . . . . . . . . . 5 . HN parsed_6qtf 1
5 1 2 . . . . . . . . . 4 . HB2 parsed_6qtf 1
6 1 1 . . . . . . . . . 4 . HA parsed_6qtf 1
6 1 2 . . . . . . . . . 5 . HN parsed_6qtf 1
7 1 1 . . . . . . . . . 2 . HA parsed_6qtf 1
7 1 2 . . . . . . . . . 3 . HA1 parsed_6qtf 1
8 1 1 . . . . . . . . . 3 . HA2 parsed_6qtf 1
8 1 2 . . . . . . . . . 4 . HN parsed_6qtf 1
9 1 1 . . . . . . . . . 4 . HN parsed_6qtf 1
9 1 2 . . . . . . . . . 3 . HA1 parsed_6qtf 1
10 1 1 . . . . . . . . . 5 . HN parsed_6qtf 1
10 1 2 . . . . . . . . . 4 . HN parsed_6qtf 1
11 1 1 . . . . . . . . . 3 . HN parsed_6qtf 1
11 1 2 . . . . . . . . . 2 . HB# parsed_6qtf 1
12 1 1 . . . . . . . . . 1 . HT# parsed_6qtf 1
12 1 2 . . . . . . . . . 3 . HN parsed_6qtf 1
13 1 1 . . . . . . . . . 2 . HA parsed_6qtf 1
13 1 2 . . . . . . . . . 4 . HN parsed_6qtf 1
14 1 1 . . . . . . . . . 5 . HN parsed_6qtf 1
14 1 2 . . . . . . . . . 2 . HN parsed_6qtf 1
15 1 1 . . . . . . . . . 1 . HA parsed_6qtf 1
15 1 2 . . . . . . . . . 5 . HA parsed_6qtf 1
16 1 1 . . . . . . . . . 1 . HB2 parsed_6qtf 1
16 1 2 . . . . . . . . . 4 . HB2 parsed_6qtf 1
17 1 1 . . . . . . . . . 4 . HB1 parsed_6qtf 1
17 1 2 . . . . . . . . . 1 . HB2 parsed_6qtf 1
18 1 1 . . . . . . . . . 4 . HA parsed_6qtf 1
18 1 2 . . . . . . . . . 1 . HA parsed_6qtf 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 . . . . . 3.3 2.6 4.0 parsed_6qtf 1
2 1 . . . . . 3.2 2.6 3.8 parsed_6qtf 1
3 1 . . . . . 3.6 2.9 4.3 parsed_6qtf 1
4 1 . . . . . 3.5 2.8 4.2 parsed_6qtf 1
5 1 . . . . . 4.2 3.4 5.0 parsed_6qtf 1
6 1 . . . . . 2.9 2.3 3.5 parsed_6qtf 1
7 1 . . . . . 4.4 3.5 5.3 parsed_6qtf 1
8 1 . . . . . 4.1 3.3 4.9 parsed_6qtf 1
9 1 . . . . . 4.3 3.4 5.2 parsed_6qtf 1
10 1 . . . . . 3.7 3.0 4.4 parsed_6qtf 1
11 1 . . . . . 4.3 3.4 5.2 parsed_6qtf 1
12 1 . . . . . 4.3 3.4 5.2 parsed_6qtf 1
13 1 . . . . . 4.3 3.4 5.2 parsed_6qtf 1
14 1 . . . . . 3.8 3.0 4.6 parsed_6qtf 1
15 1 . . . . . 3.5 2.8 4.2 parsed_6qtf 1
16 1 . . . . . 3.7 3.0 4.4 parsed_6qtf 1
17 1 . . . . . 4.2 3.4 5.0 parsed_6qtf 1
18 1 . . . . . 4.3 3.4 5.2 parsed_6qtf 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
;
echo=false
wrnlev=0
;
2 1 4 16 parsed_6qtf 1
2
;
Interresidue
i-i+1
;
5 1 6 7 parsed_6qtf 1
3 i-i+2 18 1 18 7 parsed_6qtf 1
4 i-i+3/4 21 1 21 9 parsed_6qtf 1
5 "across Lan" 24 1 24 12 parsed_6qtf 1
6
;
echo=true
wrnlev=5
;
28 1 30 16 parsed_6qtf 1
stop_
loop_
_Dist_constraint_parse_err.ID
_Dist_constraint_parse_err.Content
_Dist_constraint_parse_err.Begin_line
_Dist_constraint_parse_err.Begin_column
_Dist_constraint_parse_err.End_line
_Dist_constraint_parse_err.End_column
_Dist_constraint_parse_err.Entry_ID
_Dist_constraint_parse_err.Distance_constraint_list_ID
1 "# Restraints file 1: noe_nointra.tbl" 1 1 1 36 parsed_6qtf 1
stop_
save_
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