Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | program | type | item_count |
|
|
34784 | 1khm RC | 4405 | cing | recoord | 2-parsed | STAR | dihedral angle | 56 |
data_1khm_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1khm
_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_1khm 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1khm
_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 1khm "Master copy" parsed_1khm
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1khm
_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 1khm.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1khm 1
1 1khm.mr . . XPLOR/CNS 2 distance NOE ambi 1247 parsed_1khm 1
1 1khm.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 55 parsed_1khm 1
1 1khm.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 56 parsed_1khm 1
1 1khm.mr . . XPLOR/CNS 5 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_1khm 1
1 1khm.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1khm 1
stop_
save_
save_CNS/XPLOR_dihedral_4
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_1khm
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 4
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.00 -60.00 . . 12 . C . 13 . N . 13 . CA . 13 . C parsed_1khm 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.00 -80.00 . . 13 . C . 14 . N . 14 . CA . 14 . C parsed_1khm 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -210.00 -30.00 . . 14 . C . 15 . N . 15 . CA . 15 . C parsed_1khm 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -70.00 . . 15 . C . 16 . N . 16 . CA . 16 . C parsed_1khm 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -70.00 . . 16 . C . 17 . N . 17 . CA . 17 . C parsed_1khm 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -70.00 . . 17 . C . 18 . N . 18 . CA . 18 . C parsed_1khm 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.00 -60.00 . . 18 . C . 19 . N . 19 . CA . 19 . C parsed_1khm 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -70.00 . . 19 . C . 20 . N . 20 . CA . 20 . C parsed_1khm 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 21 . C . 22 . N . 22 . CA . 22 . C parsed_1khm 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 22 . C . 23 . N . 23 . CA . 23 . C parsed_1khm 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 24 . C . 25 . N . 25 . CA . 25 . C parsed_1khm 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 25 . C . 26 . N . 26 . CA . 26 . C parsed_1khm 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 26 . C . 27 . N . 27 . CA . 27 . C parsed_1khm 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 30 . C . 31 . N . 31 . CA . 31 . C parsed_1khm 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 33 . C . 34 . N . 34 . CA . 34 . C parsed_1khm 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 34 . C . 35 . N . 35 . CA . 35 . C parsed_1khm 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 35 . C . 36 . N . 36 . CA . 36 . C parsed_1khm 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 36 . C . 37 . N . 37 . CA . 37 . C parsed_1khm 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 37 . C . 38 . N . 38 . CA . 38 . C parsed_1khm 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 38 . C . 39 . N . 39 . CA . 39 . C parsed_1khm 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 39 . C . 40 . N . 40 . CA . 40 . C parsed_1khm 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 40 . C . 41 . N . 41 . CA . 41 . C parsed_1khm 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 41 . C . 42 . N . 42 . CA . 42 . C parsed_1khm 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -70.00 . . 45 . C . 46 . N . 46 . CA . 46 . C parsed_1khm 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -70.00 . . 46 . C . 47 . N . 47 . CA . 47 . C parsed_1khm 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -70.00 . . 47 . C . 48 . N . 48 . CA . 48 . C parsed_1khm 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -70.00 . . 48 . C . 49 . N . 49 . CA . 49 . C parsed_1khm 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 50 . C . 51 . N . 51 . CA . 51 . C parsed_1khm 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 53 . C . 54 . N . 54 . CA . 54 . C parsed_1khm 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.00 -60.00 . . 55 . C . 56 . N . 56 . CA . 56 . C parsed_1khm 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.00 -60.00 . . 56 . C . 57 . N . 57 . CA . 57 . C parsed_1khm 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.00 -60.00 . . 57 . C . 58 . N . 58 . CA . 58 . C parsed_1khm 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -70.00 . . 58 . C . 59 . N . 59 . CA . 59 . C parsed_1khm 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -70.00 . . 59 . C . 60 . N . 60 . CA . 60 . C parsed_1khm 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -70.00 . . 60 . C . 61 . N . 61 . CA . 61 . C parsed_1khm 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -70.00 . . 61 . C . 62 . N . 62 . CA . 62 . C parsed_1khm 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -70.00 . . 62 . C . 63 . N . 63 . CA . 63 . C parsed_1khm 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -170.00 -70.00 . . 63 . C . 64 . N . 64 . CA . 64 . C parsed_1khm 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 66 . C . 67 . N . 67 . CA . 67 . C parsed_1khm 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 67 . C . 68 . N . 68 . CA . 68 . C parsed_1khm 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 68 . C . 69 . N . 69 . CA . 69 . C parsed_1khm 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 69 . C . 70 . N . 70 . CA . 70 . C parsed_1khm 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 70 . C . 71 . N . 71 . CA . 71 . C parsed_1khm 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 71 . C . 72 . N . 72 . CA . 72 . C parsed_1khm 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 72 . C . 73 . N . 73 . CA . 73 . C parsed_1khm 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 73 . C . 74 . N . 74 . CA . 74 . C parsed_1khm 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 74 . C . 75 . N . 75 . CA . 75 . C parsed_1khm 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 75 . C . 76 . N . 76 . CA . 76 . C parsed_1khm 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 76 . C . 77 . N . 77 . CA . 77 . C parsed_1khm 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 77 . C . 78 . N . 78 . CA . 78 . C parsed_1khm 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 78 . C . 79 . N . 79 . CA . 79 . C parsed_1khm 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 79 . C . 80 . N . 80 . CA . 80 . C parsed_1khm 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 81 . C . 82 . N . 82 . CA . 82 . C parsed_1khm 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -20.00 . . 82 . C . 83 . N . 83 . CA . 83 . C parsed_1khm 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.00 -60.00 . . 86 . C . 87 . N . 87 . CA . 87 . C parsed_1khm 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -180.00 -60.00 . . 88 . C . 89 . N . 89 . CA . 89 . C parsed_1khm 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 from the HN-HA coupling constants" 1 1 1 56 parsed_1khm 1
stop_
save_