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 |
|
|
180141 |
2kjg   |
16320 | cing | 2-parsed | STAR | distance | NOE | ambi | 20 |
data_2kjg_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2kjg
_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_2kjg 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2kjg
_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 2kjg "Master copy" parsed_2kjg
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2kjg
_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 2kjg.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2kjg 1
1 2kjg.mr . . XPLOR/CNS 2 distance NOE simple 1702 parsed_2kjg 1
1 2kjg.mr . . XPLOR/CNS 3 distance NOE ambi 273 parsed_2kjg 1
1 2kjg.mr . . XPLOR/CNS 4 distance NOE simple 150 parsed_2kjg 1
1 2kjg.mr . . XPLOR/CNS 5 distance NOE ambi 20 parsed_2kjg 1
1 2kjg.mr . . XPLOR/CNS 6 distance NOE simple 0 parsed_2kjg 1
1 2kjg.mr . . XPLOR/CNS 7 distance NOE ambi 0 parsed_2kjg 1
1 2kjg.mr . . XPLOR/CNS 8 distance "hydrogen bond" simple 0 parsed_2kjg 1
1 2kjg.mr . . XPLOR/CNS 9 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_2kjg 1
1 2kjg.mr . . "MR format" 10 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2kjg 1
stop_
save_
save_CNS/XPLOR_distance_constraints_5
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2kjg
_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_2kjg 1
2 1 . . . parsed_2kjg 1
3 1 . . . parsed_2kjg 1
4 1 . . . parsed_2kjg 1
5 1 . . . parsed_2kjg 1
6 1 . . . parsed_2kjg 1
7 1 . . . parsed_2kjg 1
8 1 . . . parsed_2kjg 1
9 1 . . . parsed_2kjg 1
10 1 . . . parsed_2kjg 1
11 1 . . . parsed_2kjg 1
12 1 . . . parsed_2kjg 1
13 1 . . . parsed_2kjg 1
14 1 . . . parsed_2kjg 1
15 1 . . . parsed_2kjg 1
16 1 . . . parsed_2kjg 1
17 1 . . . parsed_2kjg 1
18 1 . . . parsed_2kjg 1
19 1 . . . parsed_2kjg 1
20 1 . . . parsed_2kjg 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 . . . . . . . . . 9 . HD* parsed_2kjg 1
1 1 1 . . . . . . . . . 21 . HD* parsed_2kjg 1
1 1 2 . . . . . . . . . 10 . HN parsed_2kjg 1
1 1 2 . . . . . . . . . 22 . HN parsed_2kjg 1
2 1 1 . . . . . . . . . 15 . HE* parsed_2kjg 1
2 1 2 . . . . . . . . . 12 . HA parsed_2kjg 1
2 1 2 . . . . . . . . . 15 . HA parsed_2kjg 1
3 1 1 . . . . . . . . . 15 . HD* parsed_2kjg 1
3 1 2 . . . . . . . . . 12 . HA parsed_2kjg 1
3 1 2 . . . . . . . . . 15 . HA parsed_2kjg 1
4 1 1 . . . . . . . . . 47 . HE* parsed_2kjg 1
4 1 2 . . . . . . . . . 43 . HB parsed_2kjg 1
4 1 2 . . . . . . . . . 47 . HA parsed_2kjg 1
5 1 1 . . . . . . . . . 49 . HE* parsed_2kjg 1
5 1 1 . . . . . . . . . 63 . HE* parsed_2kjg 1
5 1 2 . . . . . . . . . 63 . HA parsed_2kjg 1
6 1 1 . . . . . . . . . 52 . HD2 parsed_2kjg 1
6 1 2 . . . . . . . . . 48 . HA parsed_2kjg 1
6 1 2 . . . . . . . . . 51 . HB1 parsed_2kjg 1
7 1 1 . . . . . . . . . 9 . HD* parsed_2kjg 1
7 1 1 . . . . . . . . . 21 . HD* parsed_2kjg 1
7 1 2 . . . . . . . . . 10 . HB parsed_2kjg 1
7 1 2 . . . . . . . . . 25 . HE* parsed_2kjg 1
8 1 1 . . . . . . . . . 21 . HZ parsed_2kjg 1
8 1 2 . . . . . . . . . 25 . HB2 parsed_2kjg 1
8 1 2 . . . . . . . . . 25 . HE* parsed_2kjg 1
9 1 1 . . . . . . . . . 47 . HD* parsed_2kjg 1
9 1 2 . . . . . . . . . 31 . HB parsed_2kjg 1
9 1 2 . . . . . . . . . 48 . HB parsed_2kjg 1
10 1 1 . . . . . . . . . 73 . HD* parsed_2kjg 1
10 1 2 . . . . . . . . . 69 . HG12 parsed_2kjg 1
10 1 2 . . . . . . . . . 72 . HB2 parsed_2kjg 1
10 1 2 . . . . . . . . . 76 . HD* parsed_2kjg 1
11 1 1 . . . . . . . . . 73 . HE* parsed_2kjg 1
11 1 2 . . . . . . . . . 69 . HG12 parsed_2kjg 1
11 1 2 . . . . . . . . . 72 . HB2 parsed_2kjg 1
11 1 2 . . . . . . . . . 76 . HD* parsed_2kjg 1
12 1 1 . . . . . . . . . 74 . HD* parsed_2kjg 1
12 1 2 . . . . . . . . . 75 . HB2 parsed_2kjg 1
12 1 2 . . . . . . . . . 75 . HD* parsed_2kjg 1
13 1 1 . . . . . . . . . 74 . HD* parsed_2kjg 1
13 1 2 . . . . . . . . . 70 . HB1 parsed_2kjg 1
13 1 2 . . . . . . . . . 79 . HG2* parsed_2kjg 1
14 1 1 . . . . . . . . . 47 . HE* parsed_2kjg 1
14 1 2 . . . . . . . . . 46 . HG11 parsed_2kjg 1
14 1 2 . . . . . . . . . 48 . HG2* parsed_2kjg 1
15 1 1 . . . . . . . . . 62 . HE* parsed_2kjg 1
15 1 2 . . . . . . . . . 24 . HG2* parsed_2kjg 1
15 1 2 . . . . . . . . . 90 . HG2* parsed_2kjg 1
16 1 1 . . . . . . . . . 9 . HD* parsed_2kjg 1
16 1 1 . . . . . . . . . 21 . HD* parsed_2kjg 1
16 1 2 . . . . . . . . . 86 . HD1* parsed_2kjg 1
16 1 2 . . . . . . . . . 90 . HD1* parsed_2kjg 1
17 1 1 . . . . . . . . . 74 . HD* parsed_2kjg 1
17 1 2 . . . . . . . . . 41 . HG2* parsed_2kjg 1
17 1 2 . . . . . . . . . 75 . HG* parsed_2kjg 1
17 1 2 . . . . . . . . . 79 . HD1* parsed_2kjg 1
18 1 1 . . . . . . . . . 49 . HE* parsed_2kjg 1
18 1 2 . . . . . . . . . 27 . HG2* parsed_2kjg 1
18 1 2 . . . . . . . . . 56 . HG11 parsed_2kjg 1
18 1 2 . . . . . . . . . 82 . HG1* parsed_2kjg 1
19 1 1 . . . . . . . . . 49 . HE* parsed_2kjg 1
19 1 1 . . . . . . . . . 63 . HE* parsed_2kjg 1
19 1 2 . . . . . . . . . 19 . HG2* parsed_2kjg 1
19 1 2 . . . . . . . . . 27 . HD1* parsed_2kjg 1
20 1 1 . . . . . . . . . 49 . HE* parsed_2kjg 1
20 1 1 . . . . . . . . . 63 . HE* parsed_2kjg 1
20 1 2 . . . . . . . . . 56 . HD1* parsed_2kjg 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 . . . . . 3.65 1.80 5.50 parsed_2kjg 1
2 1 . . . . . 3.15 1.80 4.50 parsed_2kjg 1
3 1 . . . . . 3.15 1.80 4.50 parsed_2kjg 1
4 1 . . . . . 3.15 1.80 4.50 parsed_2kjg 1
5 1 . . . . . 3.15 1.80 4.50 parsed_2kjg 1
6 1 . . . . . 3.15 1.80 4.50 parsed_2kjg 1
7 1 . . . . . 3.15 1.80 4.50 parsed_2kjg 1
8 1 . . . . . 3.15 1.80 4.50 parsed_2kjg 1
9 1 . . . . . 3.65 1.80 5.50 parsed_2kjg 1
10 1 . . . . . 2.65 1.80 3.50 parsed_2kjg 1
11 1 . . . . . 3.15 1.80 4.50 parsed_2kjg 1
12 1 . . . . . 3.15 1.80 4.50 parsed_2kjg 1
13 1 . . . . . 3.15 1.80 4.50 parsed_2kjg 1
14 1 . . . . . 3.40 1.80 5.00 parsed_2kjg 1
15 1 . . . . . 2.65 1.80 3.50 parsed_2kjg 1
16 1 . . . . . 2.65 1.80 3.50 parsed_2kjg 1
17 1 . . . . . 2.30 1.80 2.80 parsed_2kjg 1
18 1 . . . . . 2.30 1.80 2.80 parsed_2kjg 1
19 1 . . . . . 2.65 1.80 3.50 parsed_2kjg 1
20 1 . . . . . 3.15 1.80 4.50 parsed_2kjg 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 9!exact:cnoear!4.97!ambig 1 138 1 164 parsed_2kjg 1
2 65!exact:cnoear!4.47!ambig 2 110 2 137 parsed_2kjg 1
3 66!exact:cnoear!4.53!ambig 3 110 3 137 parsed_2kjg 1
4 67!exact:cnoear!4.38!ambig 4 110 4 137 parsed_2kjg 1
5 78!exact:cnoear!4.27!ambig 5 111 5 138 parsed_2kjg 1
6 84!exact:cnoear!4.51!ambig 6 111 6 138 parsed_2kjg 1
7 122!exact:cnoear!4.23!ambig 7 139 7 167 parsed_2kjg 1
8 124!exact:cnoear!4.33!ambig 8 111 8 139 parsed_2kjg 1
9 126!exact:cnoear!4.89!ambig 9 110 9 138 parsed_2kjg 1
10 137!exact:cnoear!3.76!ambig 10 141 10 169 parsed_2kjg 1
11 139!exact:cnoear!4.37!ambig 11 141 11 169 parsed_2kjg 1
12 146!exact:cnoear!4.14!ambig 12 112 12 140 parsed_2kjg 1
13 159!exact:cnoear!4.33!ambig 13 113 13 141 parsed_2kjg 1
14 162!exact:cnoear!4.06!ambig 14 114 14 142 parsed_2kjg 1
15 164!exact:cnoear!4.00!ambig 15 114 15 142 parsed_2kjg 1
16 167!exact:cnoear!3.72!ambig 16 142 16 170 parsed_2kjg 1
17 171!exact:cnoear!3.20!ambig 17 142 17 170 parsed_2kjg 1
18 180!exact:cnoear!3.11!ambig 18 143 18 171 parsed_2kjg 1
19 197!exact:cnoear!3.45!ambig 19 142 19 170 parsed_2kjg 1
20 204!exact:cnoear!4.15!ambig 20 113 20 141 parsed_2kjg 1
stop_
save_
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