NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
629787 | 5v11 | 30260 | cing | 2-parsed | STAR | entry | full | 32 |
data_5v11_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_5v11 _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_5v11 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_5v11 _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 5v11 "Master copy" parsed_5v11 stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_5v11 _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 5v11.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_5v11 1 1 5v11.mr . . DYANA/DIANA 2 distance "general distance" simple 12 parsed_5v11 1 1 5v11.mr . . DYANA/DIANA 3 distance "hydrogen bond" simple 20 parsed_5v11 1 1 5v11.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_5v11 1 stop_ save_ save_MR_file_comment_1 _Org_constr_file_comment.Sf_category org_constr_file_comment _Org_constr_file_comment.Entry_ID parsed_5v11 _Org_constr_file_comment.ID 1 _Org_constr_file_comment.Constraint_file_ID 1 _Org_constr_file_comment.Block_ID 1 _Org_constr_file_comment.Details "Generated by Wattos" _Org_constr_file_comment.Comment ; *HEADER ANTIMICROBIAL PROTEIN 01-MAR-17 5V11 *TITLE SOLUTION STRUCTURE OF ARENICIN-3 SYNTHETIC ANALOG. *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: AA139; *COMPND 3 CHAIN: A; *COMPND 4 ENGINEERED: YES; *COMPND 5 OTHER_DETAILS: ARENICIN-3 SYNTHETIC ANALOG *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 ORGANISM_SCIENTIFIC: ARENICOLA MARINA; *SOURCE 4 ORGANISM_TAXID: 6344 *KEYWDS ANTIMICROBIAL PEPTIDE, B-HAIRPIN, ANTIMICROBIAL PROTEIN *EXPDTA SOLUTION NMR *NUMMDL 20 *AUTHOR I.A.EDWARDS,M.MOBLI *REVDAT 1 08-AUG-18 5V11 0 ; save_ save_DYANA/DIANA_distance_constraints_2 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_5v11 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type "general distance" _Distance_constraint_list.Constraint_file_ID 1 _Distance_constraint_list.Block_ID 2 _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_5v11 1 2 1 . . . parsed_5v11 1 3 1 . . . parsed_5v11 1 4 1 . . . parsed_5v11 1 5 1 . . . parsed_5v11 1 6 1 . . . parsed_5v11 1 7 1 . . . parsed_5v11 1 8 1 . . . parsed_5v11 1 9 1 . . . parsed_5v11 1 10 1 . . . parsed_5v11 1 11 1 . . . parsed_5v11 1 12 1 . . . parsed_5v11 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 . . . . . . . . . 3 CYSS SG parsed_5v11 1 1 1 2 . . . . . . . . . 20 CYSS SG parsed_5v11 1 2 1 1 . . . . . . . . . 3 CYSS SG parsed_5v11 1 2 1 2 . . . . . . . . . 20 CYSS CB parsed_5v11 1 3 1 1 . . . . . . . . . 3 CYSS CB parsed_5v11 1 3 1 2 . . . . . . . . . 20 CYSS SG parsed_5v11 1 4 1 1 . . . . . . . . . 7 CYSS SG parsed_5v11 1 4 1 2 . . . . . . . . . 16 CYSS SG parsed_5v11 1 5 1 1 . . . . . . . . . 7 CYSS SG parsed_5v11 1 5 1 2 . . . . . . . . . 16 CYSS CB parsed_5v11 1 6 1 1 . . . . . . . . . 7 CYSS CB parsed_5v11 1 6 1 2 . . . . . . . . . 16 CYSS SG parsed_5v11 1 7 1 1 . . . . . . . . . 3 CYSS SG parsed_5v11 1 7 1 2 . . . . . . . . . 20 CYSS SG parsed_5v11 1 8 1 1 . . . . . . . . . 3 CYSS SG parsed_5v11 1 8 1 2 . . . . . . . . . 20 CYSS CB parsed_5v11 1 9 1 1 . . . . . . . . . 3 CYSS CB parsed_5v11 1 9 1 2 . . . . . . . . . 20 CYSS SG parsed_5v11 1 10 1 1 . . . . . . . . . 7 CYSS SG parsed_5v11 1 10 1 2 . . . . . . . . . 16 CYSS SG parsed_5v11 1 11 1 1 . . . . . . . . . 7 CYSS SG parsed_5v11 1 11 1 2 . . . . . . . . . 16 CYSS CB parsed_5v11 1 12 1 1 . . . . . . . . . 7 CYSS CB parsed_5v11 1 12 1 2 . . . . . . . . . 16 CYSS SG parsed_5v11 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 . . . . . . . 2.10 parsed_5v11 1 2 1 . . . . . . . 3.10 parsed_5v11 1 3 1 . . . . . . . 3.10 parsed_5v11 1 4 1 . . . . . . . 2.10 parsed_5v11 1 5 1 . . . . . . . 3.10 parsed_5v11 1 6 1 . . . . . . . 3.10 parsed_5v11 1 7 1 . . . . . . . 1.98 parsed_5v11 1 8 1 . . . . . . . 3.00 parsed_5v11 1 9 1 . . . . . . . 3.00 parsed_5v11 1 10 1 . . . . . . . 1.98 parsed_5v11 1 11 1 . . . . . . . 3.00 parsed_5v11 1 12 1 . . . . . . . 3.00 parsed_5v11 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 "Restraints file 1: ssbond.upl" 1 1 1 31 parsed_5v11 1 2 "Restraints file 2: ssbond.lol" 8 1 8 31 parsed_5v11 1 stop_ save_ save_DYANA/DIANA_distance_constraints_3 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID parsed_5v11 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID 1 _Distance_constraint_list.Block_ID 3 _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_5v11 2 2 1 . . . parsed_5v11 2 3 1 . . . parsed_5v11 2 4 1 . . . parsed_5v11 2 5 1 . . . parsed_5v11 2 6 1 . . . parsed_5v11 2 7 1 . . . parsed_5v11 2 8 1 . . . parsed_5v11 2 9 1 . . . parsed_5v11 2 10 1 . . . parsed_5v11 2 11 1 . . . parsed_5v11 2 12 1 . . . parsed_5v11 2 13 1 . . . parsed_5v11 2 14 1 . . . parsed_5v11 2 15 1 . . . parsed_5v11 2 16 1 . . . parsed_5v11 2 17 1 . . . parsed_5v11 2 18 1 . . . parsed_5v11 2 19 1 . . . parsed_5v11 2 20 1 . . . parsed_5v11 2 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 . . . . . . . . . 4 TRP H parsed_5v11 2 1 1 2 . . . . . . . . . 19 ARG O parsed_5v11 2 2 1 1 . . . . . . . . . 4 TRP N parsed_5v11 2 2 1 2 . . . . . . . . . 19 ARG O parsed_5v11 2 3 1 1 . . . . . . . . . 19 ARG H parsed_5v11 2 3 1 2 . . . . . . . . . 4 TRP O parsed_5v11 2 4 1 1 . . . . . . . . . 19 ARG N parsed_5v11 2 4 1 2 . . . . . . . . . 4 TRP O parsed_5v11 2 5 1 1 . . . . . . . . . 17 VAL H parsed_5v11 2 5 1 2 . . . . . . . . . 6 VAL O parsed_5v11 2 6 1 1 . . . . . . . . . 17 VAL N parsed_5v11 2 6 1 2 . . . . . . . . . 6 VAL O parsed_5v11 2 7 1 1 . . . . . . . . . 6 VAL H parsed_5v11 2 7 1 2 . . . . . . . . . 17 VAL O parsed_5v11 2 8 1 1 . . . . . . . . . 6 VAL N parsed_5v11 2 8 1 2 . . . . . . . . . 17 VAL O parsed_5v11 2 9 1 1 . . . . . . . . . 15 VAL H parsed_5v11 2 9 1 2 . . . . . . . . . 8 VAL O parsed_5v11 2 10 1 1 . . . . . . . . . 15 VAL N parsed_5v11 2 10 1 2 . . . . . . . . . 8 VAL O parsed_5v11 2 11 1 1 . . . . . . . . . 4 TRP H parsed_5v11 2 11 1 2 . . . . . . . . . 19 ARG O parsed_5v11 2 12 1 1 . . . . . . . . . 4 TRP N parsed_5v11 2 12 1 2 . . . . . . . . . 19 ARG O parsed_5v11 2 13 1 1 . . . . . . . . . 19 ARG H parsed_5v11 2 13 1 2 . . . . . . . . . 4 TRP O parsed_5v11 2 14 1 1 . . . . . . . . . 19 ARG N parsed_5v11 2 14 1 2 . . . . . . . . . 4 TRP O parsed_5v11 2 15 1 1 . . . . . . . . . 17 VAL H parsed_5v11 2 15 1 2 . . . . . . . . . 6 VAL O parsed_5v11 2 16 1 1 . . . . . . . . . 17 VAL N parsed_5v11 2 16 1 2 . . . . . . . . . 6 VAL O parsed_5v11 2 17 1 1 . . . . . . . . . 6 VAL H parsed_5v11 2 17 1 2 . . . . . . . . . 17 VAL O parsed_5v11 2 18 1 1 . . . . . . . . . 6 VAL N parsed_5v11 2 18 1 2 . . . . . . . . . 17 VAL O parsed_5v11 2 19 1 1 . . . . . . . . . 15 VAL H parsed_5v11 2 19 1 2 . . . . . . . . . 8 VAL O parsed_5v11 2 20 1 1 . . . . . . . . . 15 VAL N parsed_5v11 2 20 1 2 . . . . . . . . . 8 VAL O parsed_5v11 2 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 . . . . . . . 1.70 parsed_5v11 2 2 1 . . . . . . . 2.70 parsed_5v11 2 3 1 . . . . . . . 1.70 parsed_5v11 2 4 1 . . . . . . . 2.70 parsed_5v11 2 5 1 . . . . . . . 1.70 parsed_5v11 2 6 1 . . . . . . . 2.70 parsed_5v11 2 7 1 . . . . . . . 1.70 parsed_5v11 2 8 1 . . . . . . . 2.70 parsed_5v11 2 9 1 . . . . . . . 1.70 parsed_5v11 2 10 1 . . . . . . . 2.70 parsed_5v11 2 11 1 . . . . . . . 2.20 parsed_5v11 2 12 1 . . . . . . . 3.20 parsed_5v11 2 13 1 . . . . . . . 2.20 parsed_5v11 2 14 1 . . . . . . . 3.20 parsed_5v11 2 15 1 . . . . . . . 2.20 parsed_5v11 2 16 1 . . . . . . . 3.20 parsed_5v11 2 17 1 . . . . . . . 2.20 parsed_5v11 2 18 1 . . . . . . . 3.20 parsed_5v11 2 19 1 . . . . . . . 2.20 parsed_5v11 2 20 1 . . . . . . . 3.20 parsed_5v11 2 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 "Restraints file 3: hbond.lol" 1 1 1 30 parsed_5v11 2 2 "Restraints file 4: hbond.upl" 17 1 17 30 parsed_5v11 2 stop_ save_
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