NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype | item_count |
|
|
520544 |
2l8f   |
17406 | cing | 2-parsed | STAR | distance | hydrogen bond | simple | 35 |
data_2l8f_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2l8f
_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_2l8f 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2l8f
_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 2l8f "Master copy" parsed_2l8f
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2l8f
_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 2l8f.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2l8f 1
1 2l8f.mr . . PDB 2 coordinate ensemble "Not applicable" 0 parsed_2l8f 1
1 2l8f.mr . . AMBER 3 "dihedral angle" "Not applicable" "Not applicable" 135 parsed_2l8f 1
1 2l8f.mr . . AMBER 4 distance NOE simple 197 parsed_2l8f 1
1 2l8f.mr . . AMBER 5 distance "hydrogen bond" simple 35 parsed_2l8f 1
1 2l8f.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2l8f 1
stop_
save_
save_AMBER_distance_constraints_5
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2l8f
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type "hydrogen bond"
_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_2l8f 1
2 1 . . . parsed_2l8f 1
3 1 . . . parsed_2l8f 1
4 1 . . . parsed_2l8f 1
5 1 . . . parsed_2l8f 1
6 1 . . . parsed_2l8f 1
7 1 . . . parsed_2l8f 1
8 1 . . . parsed_2l8f 1
9 1 . . . parsed_2l8f 1
10 1 . . . parsed_2l8f 1
11 1 . . . parsed_2l8f 1
12 1 . . . parsed_2l8f 1
13 1 . . . parsed_2l8f 1
14 1 . . . parsed_2l8f 1
15 1 . . . parsed_2l8f 1
16 1 . . . parsed_2l8f 1
17 1 . . . parsed_2l8f 1
18 1 . . . parsed_2l8f 1
19 1 . . . parsed_2l8f 1
20 1 . . . parsed_2l8f 1
21 1 . . . parsed_2l8f 1
22 1 . . . parsed_2l8f 1
23 1 . . . parsed_2l8f 1
24 1 . . . parsed_2l8f 1
25 1 . . . parsed_2l8f 1
26 1 . . . parsed_2l8f 1
27 1 . . . parsed_2l8f 1
28 1 . . . parsed_2l8f 1
29 1 . . . parsed_2l8f 1
30 1 . . . parsed_2l8f 1
31 1 . . . parsed_2l8f 1
32 1 . . . parsed_2l8f 1
33 1 . . . parsed_2l8f 1
34 1 . . . parsed_2l8f 1
35 1 . . . parsed_2l8f 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 . . . . . . . . 2l8f_ambr001 2 RU H1' parsed_2l8f 1
1 1 2 . . . . . . . . 2l8f_ambr001 1 RG5 N2 parsed_2l8f 1
2 1 1 . . . . . . . . 2l8f_ambr002 11 RU3 H1' parsed_2l8f 1
2 1 2 . . . . . . . . 2l8f_ambr001 1 RG5 N2 parsed_2l8f 1
3 1 1 . . . . . . . . 2l8f_ambr001 4 RA H1' parsed_2l8f 1
3 1 2 . . . . . . . . 2l8f_ambr001 3 RG N2 parsed_2l8f 1
4 1 1 . . . . . . . . 2l8f_ambr002 9 RA H1' parsed_2l8f 1
4 1 2 . . . . . . . . 2l8f_ambr001 3 RG N2 parsed_2l8f 1
5 1 1 . . . . . . . . 2l8f_ambr001 9 RC H1' parsed_2l8f 1
5 1 2 . . . . . . . . 2l8f_ambr002 3 RG N2 parsed_2l8f 1
6 1 1 . . . . . . . . 2l8f_ambr002 4 RA H1' parsed_2l8f 1
6 1 2 . . . . . . . . 2l8f_ambr002 3 RG N2 parsed_2l8f 1
7 1 1 . . . . . . . . 2l8f_ambr001 11 RU3 H1' parsed_2l8f 1
7 1 2 . . . . . . . . 2l8f_ambr001 10 RG N2 parsed_2l8f 1
8 1 1 . . . . . . . . 2l8f_ambr002 2 RG H1' parsed_2l8f 1
8 1 2 . . . . . . . . 2l8f_ambr001 10 RG N2 parsed_2l8f 1
9 1 1 . . . . . . . . 2l8f_ambr001 5 RA H5'2 parsed_2l8f 1
9 1 2 . . . . . . . . 2l8f_ambr002 5 RG H1 parsed_2l8f 1
10 1 1 . . . . . . . . 2l8f_ambr001 7 RC H41 parsed_2l8f 1
10 1 2 . . . . . . . . 2l8f_ambr002 4 RA H2 parsed_2l8f 1
11 1 1 . . . . . . . . 2l8f_ambr001 7 RC H42 parsed_2l8f 1
11 1 2 . . . . . . . . 2l8f_ambr002 4 RA H2 parsed_2l8f 1
12 1 1 . . . . . . . . 2l8f_ambr002 9 RA H62 parsed_2l8f 1
12 1 2 . . . . . . . . 2l8f_ambr001 2 RU H3 parsed_2l8f 1
13 1 1 . . . . . . . . 2l8f_ambr002 10 RC H42 parsed_2l8f 1
13 1 2 . . . . . . . . 2l8f_ambr001 1 RG5 H1 parsed_2l8f 1
14 1 1 . . . . . . . . 2l8f_ambr001 4 RA H2 parsed_2l8f 1
14 1 2 . . . . . . . . 2l8f_ambr002 6 RG H8 parsed_2l8f 1
15 1 1 . . . . . . . . 2l8f_ambr001 7 RC N4 parsed_2l8f 1
15 1 2 . . . . . . . . 2l8f_ambr002 5 RG H21 parsed_2l8f 1
16 1 1 . . . . . . . . 2l8f_ambr001 7 RC H42 parsed_2l8f 1
16 1 2 . . . . . . . . 2l8f_ambr002 5 RG H1' parsed_2l8f 1
17 1 1 . . . . . . . . 2l8f_ambr001 10 RG H1' parsed_2l8f 1
17 1 2 . . . . . . . . 2l8f_ambr002 2 RG N2 parsed_2l8f 1
18 1 1 . . . . . . . . 2l8f_ambr002 3 RG H1' parsed_2l8f 1
18 1 2 . . . . . . . . 2l8f_ambr002 2 RG N2 parsed_2l8f 1
19 1 1 . . . . . . . . 2l8f_ambr001 1 RG5 H1 parsed_2l8f 1
19 1 2 . . . . . . . . 2l8f_ambr002 10 RC N3 parsed_2l8f 1
20 1 1 . . . . . . . . 2l8f_ambr001 1 RG5 O6 parsed_2l8f 1
20 1 2 . . . . . . . . 2l8f_ambr002 10 RC H42 parsed_2l8f 1
21 1 1 . . . . . . . . 2l8f_ambr001 1 RG5 H22 parsed_2l8f 1
21 1 2 . . . . . . . . 2l8f_ambr002 10 RC O2 parsed_2l8f 1
22 1 1 . . . . . . . . 2l8f_ambr001 2 RU H3 parsed_2l8f 1
22 1 2 . . . . . . . . 2l8f_ambr002 9 RA N1 parsed_2l8f 1
23 1 1 . . . . . . . . 2l8f_ambr001 2 RU O4 parsed_2l8f 1
23 1 2 . . . . . . . . 2l8f_ambr002 9 RA H62 parsed_2l8f 1
24 1 1 . . . . . . . . 2l8f_ambr001 3 RG H1 parsed_2l8f 1
24 1 2 . . . . . . . . 2l8f_ambr002 8 RC N3 parsed_2l8f 1
25 1 1 . . . . . . . . 2l8f_ambr001 3 RG O6 parsed_2l8f 1
25 1 2 . . . . . . . . 2l8f_ambr002 8 RC H42 parsed_2l8f 1
26 1 1 . . . . . . . . 2l8f_ambr001 3 RG H22 parsed_2l8f 1
26 1 2 . . . . . . . . 2l8f_ambr002 8 RC O2 parsed_2l8f 1
27 1 1 . . . . . . . . 2l8f_ambr001 8 RC N3 parsed_2l8f 1
27 1 2 . . . . . . . . 2l8f_ambr002 3 RG H1 parsed_2l8f 1
28 1 1 . . . . . . . . 2l8f_ambr001 8 RC H42 parsed_2l8f 1
28 1 2 . . . . . . . . 2l8f_ambr002 3 RG O6 parsed_2l8f 1
29 1 1 . . . . . . . . 2l8f_ambr001 8 RC O2 parsed_2l8f 1
29 1 2 . . . . . . . . 2l8f_ambr002 3 RG H22 parsed_2l8f 1
30 1 1 . . . . . . . . 2l8f_ambr001 9 RC N3 parsed_2l8f 1
30 1 2 . . . . . . . . 2l8f_ambr002 2 RG H1 parsed_2l8f 1
31 1 1 . . . . . . . . 2l8f_ambr001 9 RC H42 parsed_2l8f 1
31 1 2 . . . . . . . . 2l8f_ambr002 2 RG O6 parsed_2l8f 1
32 1 1 . . . . . . . . 2l8f_ambr001 9 RC O2 parsed_2l8f 1
32 1 2 . . . . . . . . 2l8f_ambr002 2 RG H22 parsed_2l8f 1
33 1 1 . . . . . . . . 2l8f_ambr001 10 RG H1 parsed_2l8f 1
33 1 2 . . . . . . . . 2l8f_ambr002 1 RC5 N3 parsed_2l8f 1
34 1 1 . . . . . . . . 2l8f_ambr001 10 RG O6 parsed_2l8f 1
34 1 2 . . . . . . . . 2l8f_ambr002 1 RC5 H42 parsed_2l8f 1
35 1 1 . . . . . . . . 2l8f_ambr001 10 RG H22 parsed_2l8f 1
35 1 2 . . . . . . . . 2l8f_ambr002 1 RC5 O2 parsed_2l8f 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 . . . . . 4.80 2.00 5.30 parsed_2l8f 1
2 1 . . . . . 4.80 2.00 5.30 parsed_2l8f 1
3 1 . . . . . 4.60 2.00 5.10 parsed_2l8f 1
4 1 . . . . . 4.90 2.10 5.40 parsed_2l8f 1
5 1 . . . . . 5.10 2.10 5.60 parsed_2l8f 1
6 1 . . . . . 5.20 2.20 5.70 parsed_2l8f 1
7 1 . . . . . 4.80 2.00 5.30 parsed_2l8f 1
8 1 . . . . . 4.80 2.00 5.30 parsed_2l8f 1
9 1 . . . . . 10.00 4.00 10.50 parsed_2l8f 1
10 1 . . . . . 4.50 1.90 5.00 parsed_2l8f 1
11 1 . . . . . 3.90 1.70 4.40 parsed_2l8f 1
12 1 . . . . . 3.50 1.30 4.00 parsed_2l8f 1
13 1 . . . . . 3.40 1.20 3.90 parsed_2l8f 1
14 1 . . . . . 5.20 2.20 5.70 parsed_2l8f 1
15 1 . . . . . 5.30 2.30 5.80 parsed_2l8f 1
16 1 . . . . . 7.50 2.50 8.00 parsed_2l8f 1
17 1 . . . . . 4.60 2.00 5.10 parsed_2l8f 1
18 1 . . . . . 4.60 2.00 5.10 parsed_2l8f 1
19 1 . . . . . 2.40 1.80 2.90 parsed_2l8f 1
20 1 . . . . . 2.40 1.80 2.90 parsed_2l8f 1
21 1 . . . . . 2.40 1.80 2.90 parsed_2l8f 1
22 1 . . . . . 2.40 1.80 2.90 parsed_2l8f 1
23 1 . . . . . 2.40 1.80 2.90 parsed_2l8f 1
24 1 . . . . . 2.40 1.80 2.90 parsed_2l8f 1
25 1 . . . . . 2.40 1.80 2.90 parsed_2l8f 1
26 1 . . . . . 2.40 1.80 2.90 parsed_2l8f 1
27 1 . . . . . 2.40 1.80 2.90 parsed_2l8f 1
28 1 . . . . . 2.40 1.80 2.90 parsed_2l8f 1
29 1 . . . . . 2.40 1.80 2.90 parsed_2l8f 1
30 1 . . . . . 2.40 1.80 2.90 parsed_2l8f 1
31 1 . . . . . 2.40 1.80 2.90 parsed_2l8f 1
32 1 . . . . . 2.40 1.80 2.90 parsed_2l8f 1
33 1 . . . . . 2.40 1.80 2.90 parsed_2l8f 1
34 1 . . . . . 2.40 1.80 2.90 parsed_2l8f 1
35 1 . . . . . 2.40 1.80 2.90 parsed_2l8f 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 "2 RU H1' 1 RG5 N2 2.00 4.80" 1 1 1 47 parsed_2l8f 1
2 "22 RU3 H1' 1 RG5 N2 2.00 4.80" 4 1 5 47 parsed_2l8f 1
3 "4 RA H1' 3 RG N2 2.00 4.60" 8 1 9 47 parsed_2l8f 1
4 "20 RA H1' 3 RG N2 2.10 4.90" 12 1 13 47 parsed_2l8f 1
5 "9 RC H1' 14 RG N2 2.10 5.10" 16 1 17 47 parsed_2l8f 1
6 "15 RA H1' 14 RG N2 2.20 5.20" 20 1 21 47 parsed_2l8f 1
7 "11 RU3 H1' 10 RG N2 2.00 4.80" 24 1 25 47 parsed_2l8f 1
8 "13 RG H1' 10 RG N2 2.00 4.80" 28 1 29 47 parsed_2l8f 1
9 "5 RA H5'' 16 RG H1 4.00 10.00" 32 1 33 47 parsed_2l8f 1
10 "7 RC H41 15 RA H2 1.90 4.50" 36 1 37 47 parsed_2l8f 1
11 "7 RC H42 15 RA H2 1.70 3.90" 40 1 41 47 parsed_2l8f 1
12 "20 RA H62 2 RU H3 1.30 3.50" 44 1 45 47 parsed_2l8f 1
13 "21 RC H42 1 RG5 H1 1.20 3.40" 48 1 49 47 parsed_2l8f 1
14 "4 RA H2 17 RG H8 2.20 5.20" 52 1 53 47 parsed_2l8f 1
15 "7 RC N4 16 RG H21 2.30 5.30" 56 1 57 47 parsed_2l8f 1
16 "7 RC H42 16 RG H1' 2.50 7.50" 60 1 61 47 parsed_2l8f 1
17 "10 RG H1' 13 RG N2 2.00 4.60" 64 1 65 47 parsed_2l8f 1
18 "14 RG H1' 13 RG N2 2.00 4.60" 68 1 69 47 parsed_2l8f 1
19 "1 RG5 H1 21 RC N3 1.80 2.40" 72 1 73 47 parsed_2l8f 1
20 "1 RG5 O6 21 RC H42 1.80 2.40" 78 1 79 47 parsed_2l8f 1
21 "1 RG5 H22 21 RC O2 1.80 2.40" 82 1 83 47 parsed_2l8f 1
22 "2 RU H3 20 RA N1 1.80 2.40" 86 1 87 47 parsed_2l8f 1
23 "2 RU O4 20 RA H62 1.80 2.40" 90 1 91 47 parsed_2l8f 1
24 "3 RG H1 19 RC N3 1.80 2.40" 94 1 95 47 parsed_2l8f 1
25 "3 RG O6 19 RC H42 1.80 2.40" 98 1 99 47 parsed_2l8f 1
26 "3 RG H22 19 RC O2 1.80 2.40" 102 1 103 47 parsed_2l8f 1
27 "8 RC N3 14 RG H1 1.80 2.40" 106 1 107 47 parsed_2l8f 1
28 "8 RC H42 14 RG O6 1.80 2.40" 110 1 111 47 parsed_2l8f 1
29 "8 RC O2 14 RG H22 1.80 2.40" 114 1 115 47 parsed_2l8f 1
30 "9 RC N3 13 RG H1 1.80 2.40" 118 1 119 47 parsed_2l8f 1
31 "9 RC H42 13 RG O6 1.80 2.40" 122 1 123 47 parsed_2l8f 1
32 "9 RC O2 13 RG H22 1.80 2.40" 126 1 127 47 parsed_2l8f 1
33 "10 RG H1 12 RC5 N3 1.80 2.40" 130 1 131 47 parsed_2l8f 1
34 "10 RG O6 12 RC5 H42 1.80 2.40" 134 1 135 47 parsed_2l8f 1
35 "10 RG H22 12 RC5 O2 1.80 2.40" 138 1 139 47 parsed_2l8f 1
stop_
save_
Contact the webmaster for help, if required. Friday, May 17, 2024 1:25:21 AM GMT (wattos1)