NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type |
603592 | 5j0m | 30046 | cing | 2-parsed | STAR | comment |
data_5j0m_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_5j0m _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_5j0m 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_5j0m _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 5j0m "Master copy" parsed_5j0m stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_5j0m _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 5j0m.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_5j0m 1 1 5j0m.mr . . XPLOR/CNS 2 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_5j0m 1 1 5j0m.mr . . "MR format" 3 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_5j0m 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_5j0m _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 VIRAL PROTEIN 28-MAR-16 5J0M *TITLE GROUND STATE SAMPLED DURING RDC RESTRAINED REPLICA-AVERAGED *TITLE 2 METADYNAMICS (RAM) SIMULATIONS OF THE HIV-1 TAR COMPLEXED WITH CYCLIC *TITLE 3 PEPTIDE MIMETIC OF TAT *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: CYCLIC PEPTIDE MIMETIC OF HIV-1 TAT; *COMPND 3 CHAIN: A; *COMPND 4 ENGINEERED: YES; *COMPND 5 MOL_ID: 2; *COMPND 6 MOLECULE: APICAL REGION (29-MER) OF THE HIV-1 TAR RNA ELEMENT; *COMPND 7 CHAIN: B; *COMPND 8 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 SYNTHETIC: YES; *SOURCE 3 ORGANISM_SCIENTIFIC: HUMAN IMMUNODEFICIENCY VIRUS 1; *SOURCE 4 ORGANISM_TAXID: 11676; *SOURCE 5 MOL_ID: 2; *SOURCE 6 ORGANISM_SCIENTIFIC: HUMAN IMMUNODEFICIENCY VIRUS 1; *SOURCE 7 ORGANISM_TAXID: 11676; *SOURCE 8 EXPRESSION_SYSTEM: IN VITRO TRANSCRIPTION VECTOR PT7-FLUC(DELTAI); *SOURCE 9 EXPRESSION_SYSTEM_TAXID: 905932 *KEYWDS TAR:TAT COMPLEX, RAM SIMULATIONS, RESIDUAL DIPOLAR COUPLINGS, GROUND *KEYWDS 2 STATE, VIRAL PROTEIN *EXPDTA SOLUTION NMR *NUMMDL 10 *AUTHOR A.N.BORKAR,M.F.BARDARO JR.,G.VARANI,M.VENDRUCOLO *REVDAT 1 08-JUN-16 5J0M 0 # Restraints file 1: TARpRAM_pf1.txt !RDC restraints used for generation of the TAR:Tat-peptide RAM ensemble !RDCs measured in aprox 12mg/ml phage !0.6 mM fully labeled sample, 10 mM K phosphate buffer !with 0.1 mM EDTA pH 6.6, Da/R -30 and 0.25 !Average experimental error 2.0 ; save_
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