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 | item_count |
|
|
528493 |
2lai   |
17525 | cing | 2-parsed | STAR | dihedral angle | 43 |
data_2lai_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2lai
_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_2lai 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2lai
_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 2lai "Master copy" parsed_2lai
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2lai
_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 2lai.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2lai 1
1 2lai.mr . . XPLOR/CNS 2 distance NOE simple 449 parsed_2lai 1
1 2lai.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 28 parsed_2lai 1
1 2lai.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 43 parsed_2lai 1
1 2lai.mr . . XPLOR/CNS 5 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2lai 1
1 2lai.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2lai 1
stop_
save_
save_CNS/XPLOR_dihedral_4
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2lai
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 56 . C . 57 . N . 57 . CA . 57 . C parsed_2lai 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 58 . C . 59 . N . 59 . CA . 59 . C parsed_2lai 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 59 . C . 60 . N . 60 . CA . 60 . C parsed_2lai 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -80.0 . . 60 . C . 61 . N . 61 . CA . 61 . C parsed_2lai 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 66 . C . 67 . N . 67 . CA . 67 . C parsed_2lai 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 68 . C . 69 . N . 69 . CA . 69 . C parsed_2lai 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 71 . C . 72 . N . 72 . CA . 72 . C parsed_2lai 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 73 . C . 74 . N . 74 . CA . 74 . C parsed_2lai 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 78 . C . 79 . N . 79 . CA . 79 . C parsed_2lai 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 80 . C . 81 . N . 81 . CA . 81 . C parsed_2lai 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 83 . C . 84 . N . 84 . CA . 84 . C parsed_2lai 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 84 . C . 85 . N . 85 . CA . 85 . C parsed_2lai 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 87 . C . 88 . N . 88 . CA . 88 . C parsed_2lai 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 89 . C . 90 . N . 90 . CA . 90 . C parsed_2lai 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 90 . C . 91 . N . 91 . CA . 91 . C parsed_2lai 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 92 . C . 93 . N . 93 . CA . 93 . C parsed_2lai 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 93 . C . 94 . N . 94 . CA . 94 . C parsed_2lai 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 95 . C . 96 . N . 96 . CA . 96 . C parsed_2lai 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -80.0 . . 118 . C . 119 . N . 119 . CA . 119 . C parsed_2lai 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 124 . C . 125 . N . 125 . CA . 125 . C parsed_2lai 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 125 . C . 126 . N . 126 . CA . 126 . C parsed_2lai 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 126 . C . 127 . N . 127 . CA . 127 . C parsed_2lai 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 127 . C . 128 . N . 128 . CA . 128 . C parsed_2lai 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 128 . C . 129 . N . 129 . CA . 129 . C parsed_2lai 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 129 . C . 130 . N . 130 . CA . 130 . C parsed_2lai 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 130 . C . 131 . N . 131 . CA . 131 . C parsed_2lai 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 131 . C . 132 . N . 132 . CA . 132 . C parsed_2lai 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 132 . C . 133 . N . 133 . CA . 133 . C parsed_2lai 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -200.0 -80.0 . . 133 . C . 134 . N . 134 . CA . 134 . C parsed_2lai 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 134 . C . 135 . N . 135 . CA . 135 . C parsed_2lai 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 135 . C . 136 . N . 136 . CA . 136 . C parsed_2lai 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 137 . C . 138 . N . 138 . CA . 138 . C parsed_2lai 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 140 . C . 141 . N . 141 . CA . 141 . C parsed_2lai 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 141 . C . 142 . N . 142 . CA . 142 . C parsed_2lai 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 142 . C . 143 . N . 143 . CA . 143 . C parsed_2lai 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 144 . C . 145 . N . 145 . CA . 145 . C parsed_2lai 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 145 . C . 146 . N . 146 . CA . 146 . C parsed_2lai 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 146 . C . 147 . N . 147 . CA . 147 . C parsed_2lai 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 147 . C . 148 . N . 148 . CA . 148 . C parsed_2lai 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 148 . C . 149 . N . 149 . CA . 149 . C parsed_2lai 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 149 . C . 150 . N . 150 . CA . 150 . C parsed_2lai 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 150 . C . 151 . N . 151 . CA . 151 . C parsed_2lai 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.0 80.0 . . 151 . C . 152 . N . 152 . CA . 152 . C parsed_2lai 1
stop_
save_
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