NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | item_count |
|
|
29102 |
1aj4   |
cing | 2-parsed | STAR | dihedral angle | 87 |
data_1aj4_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1aj4
_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_1aj4 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1aj4
_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 1aj4 "Master copy" parsed_1aj4
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1aj4
_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 1aj4.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1aj4 1
1 1aj4.mr . . XPLOR/CNS 2 distance "general distance" simple 1244 parsed_1aj4 1
1 1aj4.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 105 parsed_1aj4 1
1 1aj4.mr . . XPLOR/CNS 4 distance "general distance" simple 1120 parsed_1aj4 1
1 1aj4.mr . . XPLOR/CNS 5 "dihedral angle" "Not applicable" "Not applicable" 87 parsed_1aj4 1
1 1aj4.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1aj4 1
stop_
save_
save_CNS/XPLOR_dihedral_5
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_1aj4
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 5
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -163.0 -77.0 . . 86 . C . 87 . N . 87 . CA . 87 . C parsed_1aj4 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -163.0 -77.0 . . 87 . C . 88 . N . 88 . CA . 88 . C parsed_1aj4 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.0 -45.0 . . 94 . C . 95 . N . 95 . CA . 95 . C parsed_1aj4 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.5 -50.5 . . 95 . C . 96 . N . 96 . CA . 96 . C parsed_1aj4 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -87.0 -47.0 . . 96 . C . 97 . N . 97 . CA . 97 . C parsed_1aj4 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.5 -39.5 . . 97 . C . 98 . N . 98 . CA . 98 . C parsed_1aj4 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.5 -43.5 . . 99 . C . 100 . N . 100 . CA . 100 . C parsed_1aj4 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -82.5 -42.5 . . 101 . C . 102 . N . 102 . CA . 102 . C parsed_1aj4 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -157.0 -83.0 . . 103 . C . 104 . N . 104 . CA . 104 . C parsed_1aj4 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.0 -39.0 . . 105 . C . 106 . N . 106 . CA . 106 . C parsed_1aj4 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -149.0 -91.0 . . 108 . C . 109 . N . 109 . CA . 109 . C parsed_1aj4 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -151.0 -89.0 . . 110 . C . 111 . N . 111 . CA . 111 . C parsed_1aj4 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -152.0 -88.0 . . 111 . C . 112 . N . 112 . CA . 112 . C parsed_1aj4 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -146.0 -94.0 . . 112 . C . 113 . N . 113 . CA . 113 . C parsed_1aj4 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -69.0 -29.0 . . 113 . C . 114 . N . 114 . CA . 114 . C parsed_1aj4 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86.0 -46.0 . . 115 . C . 116 . N . 116 . CA . 116 . C parsed_1aj4 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.5 -39.5 . . 116 . C . 117 . N . 117 . CA . 117 . C parsed_1aj4 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -89.5 -49.5 . . 122 . C . 123 . N . 123 . CA . 123 . C parsed_1aj4 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -157.0 -83.0 . . 123 . C . 124 . N . 124 . CA . 124 . C parsed_1aj4 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -154.0 -86.0 . . 127 . C . 128 . N . 128 . CA . 128 . C parsed_1aj4 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -158.0 -82.0 . . 128 . C . 129 . N . 129 . CA . 129 . C parsed_1aj4 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.5 -33.5 . . 129 . C . 130 . N . 130 . CA . 130 . C parsed_1aj4 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -92.0 -52.0 . . 131 . C . 132 . N . 132 . CA . 132 . C parsed_1aj4 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.5 -40.5 . . 133 . C . 134 . N . 134 . CA . 134 . C parsed_1aj4 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -89.0 -49.0 . . 134 . C . 135 . N . 135 . CA . 135 . C parsed_1aj4 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -89.0 -49.0 . . 141 . C . 142 . N . 142 . CA . 142 . C parsed_1aj4 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -147.0 -93.0 . . 142 . C . 143 . N . 143 . CA . 143 . C parsed_1aj4 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.0 -90.0 . . 147 . C . 148 . N . 148 . CA . 148 . C parsed_1aj4 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -149.0 -91.0 . . 148 . C . 149 . N . 149 . CA . 149 . C parsed_1aj4 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.0 -30.0 . . 149 . C . 150 . N . 150 . CA . 150 . C parsed_1aj4 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -82.5 -42.5 . . 151 . C . 152 . N . 152 . CA . 152 . C parsed_1aj4 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.5 -35.5 . . 152 . C . 153 . N . 153 . CA . 153 . C parsed_1aj4 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -78.0 -38.0 . . 153 . C . 154 . N . 154 . CA . 154 . C parsed_1aj4 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -93.5 -53.5 . . 154 . C . 155 . N . 155 . CA . 155 . C parsed_1aj4 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -92.0 -52.0 . . 156 . C . 157 . N . 157 . CA . 157 . C parsed_1aj4 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -92.0 -52.0 . . 157 . C . 158 . N . 158 . CA . 158 . C parsed_1aj4 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -162.0 -78.0 . . 160 . C . 161 . N . 161 . CA . 161 . C parsed_1aj4 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 135 . C . 136 . N . 136 . CA . 136 . C parsed_1aj4 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 136 . C . 137 . N . 137 . CA . 137 . C parsed_1aj4 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . . 137 . C . 138 . N . 138 . CA . 138 . C parsed_1aj4 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . . 138 . C . 139 . N . 139 . CA . 139 . C parsed_1aj4 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 220.0 . . 92 . N . 92 . CA . 92 . C . 93 . N parsed_1aj4 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 220.0 . . 93 . N . 93 . CA . 93 . C . 94 . N parsed_1aj4 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.0 80.0 . . 94 . N . 94 . CA . 94 . C . 95 . N parsed_1aj4 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.0 80.0 . . 96 . N . 96 . CA . 96 . C . 97 . N parsed_1aj4 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.0 80.0 . . 99 . N . 99 . CA . 99 . C . 100 . N parsed_1aj4 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.0 80.0 . . 100 . N . 100 . CA . 100 . C . 101 . N parsed_1aj4 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.0 80.0 . . 101 . N . 101 . CA . 101 . C . 102 . N parsed_1aj4 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 220.0 . . 105 . N . 105 . CA . 105 . C . 106 . N parsed_1aj4 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 220.0 . . 111 . N . 111 . CA . 111 . C . 112 . N parsed_1aj4 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 220.0 . . 112 . N . 112 . CA . 112 . C . 113 . N parsed_1aj4 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 220.0 . . 113 . N . 113 . CA . 113 . C . 114 . N parsed_1aj4 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.0 80.0 . . 115 . N . 115 . CA . 115 . C . 116 . N parsed_1aj4 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.0 80.0 . . 122 . N . 122 . CA . 122 . C . 123 . N parsed_1aj4 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 220.0 . . 129 . N . 129 . CA . 129 . C . 130 . N parsed_1aj4 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.0 80.0 . . 130 . N . 130 . CA . 130 . C . 131 . N parsed_1aj4 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.0 80.0 . . 132 . N . 132 . CA . 132 . C . 133 . N parsed_1aj4 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.0 80.0 . . 134 . N . 134 . CA . 134 . C . 135 . N parsed_1aj4 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 220.0 . . 141 . N . 141 . CA . 141 . C . 142 . N parsed_1aj4 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.0 80.0 . . 142 . N . 142 . CA . 142 . C . 143 . N parsed_1aj4 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 220.0 . . 147 . N . 147 . CA . 147 . C . 148 . N parsed_1aj4 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 20.0 220.0 . . 149 . N . 149 . CA . 149 . C . 150 . N parsed_1aj4 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.0 80.0 . . 151 . N . 151 . CA . 151 . C . 152 . N parsed_1aj4 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.0 80.0 . . 153 . N . 153 . CA . 153 . C . 154 . N parsed_1aj4 1
65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.0 80.0 . . 154 . N . 154 . CA . 154 . C . 155 . N parsed_1aj4 1
66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.0 80.0 . . 156 . N . 156 . CA . 156 . C . 157 . N parsed_1aj4 1
67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -140.0 80.0 . . 157 . N . 157 . CA . 157 . C . 158 . N parsed_1aj4 1
68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 112 . N . 112 . CA . 112 . CB . 112 . CG1 parsed_1aj4 1
69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 119 . N . 119 . CA . 119 . CB . 119 . CG1 parsed_1aj4 1
70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 96 . N . 96 . CA . 96 . CB . 96 . CG parsed_1aj4 1
71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 97 . N . 97 . CA . 97 . CB . 97 . CG parsed_1aj4 1
72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 99 . N . 99 . CA . 99 . CB . 99 . CG parsed_1aj4 1
73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 104 . N . 104 . CA . 104 . CB . 104 . CG parsed_1aj4 1
74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 111 . N . 111 . CA . 111 . CB . 111 . CG parsed_1aj4 1
75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 120.0 . . 113 . N . 113 . CA . 113 . CB . 113 . CG parsed_1aj4 1
76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 121 . N . 121 . CA . 121 . CB . 121 . CG parsed_1aj4 1
77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 126 . N . 126 . CA . 126 . CB . 126 . CG parsed_1aj4 1
78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 132 . N . 132 . CA . 132 . CB . 132 . CG parsed_1aj4 1
79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 120.0 . . 143 . N . 143 . CA . 143 . CB . 143 . CG parsed_1aj4 1
80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 144 . N . 144 . CA . 144 . CB . 144 . CG parsed_1aj4 1
81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 148 . N . 148 . CA . 148 . CB . 148 . CG1 parsed_1aj4 1
82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0.0 120.0 . . 149 . N . 149 . CA . 149 . CB . 149 . CG parsed_1aj4 1
83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.0 240.0 . . 150 . N . 150 . CA . 150 . CB . 150 . CG parsed_1aj4 1
84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 151 . N . 151 . CA . 151 . CB . 151 . CG parsed_1aj4 1
85 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.0 240.0 . . 153 . N . 153 . CA . 153 . CB . 153 . CG parsed_1aj4 1
86 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 0.0 . . 154 . N . 154 . CA . 154 . CB . 154 . CG parsed_1aj4 1
87 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.0 240.0 . . 160 . N . 160 . CA . 160 . CB . 160 . CG1 parsed_1aj4 1
stop_
save_
Contact the webmaster for help, if required. Wednesday, April 24, 2024 10:51:53 PM GMT (wattos1)