NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | program | type | item_count |
|
|
35522 |
1lsi   |
4159 | cing | recoord | 2-parsed | STAR | dihedral angle | 45 |
data_1lsi_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1lsi
_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_1lsi 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1lsi
_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 1lsi "Master copy" parsed_1lsi
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1lsi
_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 1lsi.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1lsi 1
1 1lsi.mr . . XPLOR/CNS 2 distance NOE simple 133 parsed_1lsi 1
1 1lsi.mr . . n/a 3 comment "Not applicable" "Not applicable" 0 parsed_1lsi 1
1 1lsi.mr . . XPLOR/CNS 4 distance NOE simple 210 parsed_1lsi 1
1 1lsi.mr . . n/a 5 comment "Not applicable" "Not applicable" 0 parsed_1lsi 1
1 1lsi.mr . . XPLOR/CNS 6 distance NOE simple 135 parsed_1lsi 1
1 1lsi.mr . . n/a 7 comment "Not applicable" "Not applicable" 0 parsed_1lsi 1
1 1lsi.mr . . XPLOR/CNS 8 distance "hydrogen bond" simple 20 parsed_1lsi 1
1 1lsi.mr . . n/a 9 comment "Not applicable" "Not applicable" 0 parsed_1lsi 1
1 1lsi.mr . . XPLOR/CNS 10 "dihedral angle" "Not applicable" "Not applicable" 45 parsed_1lsi 1
1 1lsi.mr . . n/a 11 comment "Not applicable" "Not applicable" 0 parsed_1lsi 1
1 1lsi.mr . . XPLOR/CNS 12 "coupling constant" "Not applicable" "Not applicable" 0 parsed_1lsi 1
1 1lsi.mr . . n/a 13 comment "Not applicable" "Not applicable" 0 parsed_1lsi 1
1 1lsi.mr . . "MR format" 14 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1lsi 1
stop_
save_
save_CNS/XPLOR_dihedral_10
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_1lsi
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 10
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170 -70 . . 1 . C . 2 . N . 2 . CA . 2 . C parsed_1lsi 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170 -70 . . 16 . C . 17 . N . 17 . CA . 17 . C parsed_1lsi 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170 -70 . . 14 . C . 15 . N . 15 . CA . 15 . C parsed_1lsi 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170 -70 . . 17 . C . 18 . N . 18 . CA . 18 . C parsed_1lsi 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170 -70 . . 18 . C . 19 . N . 19 . CA . 19 . C parsed_1lsi 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170 -70 . . 19 . C . 20 . N . 20 . CA . 20 . C parsed_1lsi 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170 -70 . . 20 . C . 21 . N . 21 . CA . 21 . C parsed_1lsi 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170 -70 . . 21 . C . 22 . N . 22 . CA . 22 . C parsed_1lsi 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170 -70 . . 22 . C . 23 . N . 23 . CA . 23 . C parsed_1lsi 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170 -70 . . 23 . C . 24 . N . 24 . CA . 24 . C parsed_1lsi 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170 -70 . . 24 . C . 25 . N . 25 . CA . 25 . C parsed_1lsi 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170 -70 . . 25 . C . 26 . N . 26 . CA . 26 . C parsed_1lsi 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170 -70 . . 26 . C . 27 . N . 27 . CA . 27 . C parsed_1lsi 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170 -70 . . 28 . C . 29 . N . 29 . CA . 29 . C parsed_1lsi 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90 -40 . . 29 . C . 30 . N . 30 . CA . 30 . C parsed_1lsi 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90 -40 . . 30 . C . 31 . N . 31 . CA . 31 . C parsed_1lsi 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170 -70 . . 32 . C . 33 . N . 33 . CA . 33 . C parsed_1lsi 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90 -40 . . 34 . C . 35 . N . 35 . CA . 35 . C parsed_1lsi 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170 -70 . . 35 . C . 36 . N . 36 . CA . 36 . C parsed_1lsi 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170 -70 . . 36 . C . 37 . N . 37 . CA . 37 . C parsed_1lsi 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170 -70 . . 37 . C . 38 . N . 38 . CA . 38 . C parsed_1lsi 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170 -70 . . 40 . C . 41 . N . 41 . CA . 41 . C parsed_1lsi 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170 -70 . . 46 . C . 47 . N . 47 . CA . 47 . C parsed_1lsi 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170 -70 . . 47 . C . 48 . N . 48 . CA . 48 . C parsed_1lsi 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90 -40 . . 49 . C . 50 . N . 50 . CA . 50 . C parsed_1lsi 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170 -70 . . 51 . C . 52 . N . 52 . CA . 52 . C parsed_1lsi 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170 -70 . . 53 . C . 54 . N . 54 . CA . 54 . C parsed_1lsi 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140 -100 . . 55 . C . 56 . N . 56 . CA . 56 . C parsed_1lsi 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170 -70 . . 58 . C . 59 . N . 59 . CA . 59 . C parsed_1lsi 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140 -100 . . 60 . C . 61 . N . 61 . CA . 61 . C parsed_1lsi 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170 -70 . . 62 . C . 63 . N . 63 . CA . 63 . C parsed_1lsi 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 3 . N . 3 . CA . 3 . CB . 3 . SG parsed_1lsi 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 5 . N . 5 . CA . 5 . CB . 5 . CG parsed_1lsi 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160 200 . . 13 . N . 13 . CA . 13 . CB . 13 . SG parsed_1lsi 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 40 80 . . 21 . N . 21 . CA . 21 . CB . 21 . CG parsed_1lsi 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 40 80 . . 25 . N . 25 . CA . 25 . CB . 25 . CG parsed_1lsi 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80 -40 . . 29 . N . 29 . CA . 29 . CB . 29 . CG parsed_1lsi 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160 320 . . 37 . N . 37 . CA . 37 . CB . 37 . CG parsed_1lsi 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160 200 . . 41 . N . 41 . CA . 41 . CB . 41 . SG parsed_1lsi 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160 200 . . 45 . N . 45 . CA . 45 . CB . 45 . SG parsed_1lsi 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160 200 . . 49 . N . 49 . CA . 49 . CB . 49 . CG parsed_1lsi 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160 200 . . 57 . N . 57 . CA . 57 . CB . 57 . SG parsed_1lsi 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160 200 . . 60 . N . 60 . CA . 60 . CB . 60 . CG parsed_1lsi 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 40 80 . . 63 . N . 63 . CA . 63 . CB . 63 . CG parsed_1lsi 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160 200 . . 65 . N . 65 . CA . 65 . CB . 65 . CG parsed_1lsi 1
stop_
loop_
_TA_constraint_comment_org.ID
_TA_constraint_comment_org.Comment_text
_TA_constraint_comment_org.Comment_begin_line
_TA_constraint_comment_org.Comment_begin_column
_TA_constraint_comment_org.Comment_end_line
_TA_constraint_comment_org.Comment_end_column
_TA_constraint_comment_org.Entry_ID
_TA_constraint_comment_org.Torsion_angle_constraint_list_ID
1 "phi angle restraints" 1 1 1 23 parsed_1lsi 1
2 "Chi1 angle restraints" 67 1 67 24 parsed_1lsi 1
stop_
save_
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