NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | program | type |
|
|
29205 |
1amb   |
cing | 2-parsed | STAR | comment |
data_1amb_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1amb
_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_1amb 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1amb
_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 1amb "Master copy" parsed_1amb
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1amb
_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 1amb.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1amb 1
1 1amb.mr . . n/a 2 comment "Not applicable" "Not applicable" 0 parsed_1amb 1
1 1amb.mr . . XPLOR/CNS 3 distance NOE simple 0 parsed_1amb 1
1 1amb.mr . . n/a 4 comment "Not applicable" "Not applicable" 0 parsed_1amb 1
1 1amb.mr . . XPLOR/CNS 5 distance NOE simple 0 parsed_1amb 1
1 1amb.mr . . n/a 6 comment "Not applicable" "Not applicable" 0 parsed_1amb 1
1 1amb.mr . . XPLOR/CNS 7 distance NOE simple 0 parsed_1amb 1
1 1amb.mr . . n/a 8 comment "Not applicable" "Not applicable" 0 parsed_1amb 1
1 1amb.mr . . XPLOR/CNS 9 distance "hydrogen bond" simple 0 parsed_1amb 1
1 1amb.mr . . n/a 10 comment "Not applicable" "Not applicable" 0 parsed_1amb 1
1 1amb.mr . . XPLOR/CNS 11 distance "hydrogen bond" simple 0 parsed_1amb 1
1 1amb.mr . . n/a 12 comment "Not applicable" "Not applicable" 0 parsed_1amb 1
1 1amb.mr . . XPLOR/CNS 13 distance "hydrogen bond" simple 0 parsed_1amb 1
1 1amb.mr . . n/a 14 comment "Not applicable" "Not applicable" 0 parsed_1amb 1
1 1amb.mr . . XPLOR/CNS 15 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_1amb 1
1 1amb.mr . . n/a 16 comment "Not applicable" "Not applicable" 0 parsed_1amb 1
1 1amb.mr . . XPLOR/CNS 17 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_1amb 1
1 1amb.mr . . n/a 18 comment "Not applicable" "Not applicable" 0 parsed_1amb 1
1 1amb.mr . . "MR format" 19 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1amb 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_1amb
_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 PROTEINASE INHIBITOR(TRYPSIN) 21-OCT-94 1AMB
*COMPND ALZHEIMER'S DISEASE AMYLOID BETA-PEPTIDE (RESIDUES 1 - 28)
*COMPND 2 (E.C. NUMBER NOT ASSIGNED) (NMR, MINIMIZED AVERAGE
*COMPND 3 STRUCTURE)
*SOURCE HUMAN (HOMO SAPIENS)
*AUTHOR J.TALAFOUS,K.J.MARCINOWSKI,G.KLOPMAN,M.G.ZAGORSKI
*REVDAT 1 20-DEC-94 1AMB 0
* NO STANDARDS HAVE YET BEEN SET FOR THE PRESENTATION OF NMR RESTRAINT
* DATA. HOWEVER, THIS FILE CONTAINS ALL RESTRAINTS USED IN THE
* SOLUTION OF THE ALZHEIMER'S DISEASE BETA-(1-28) AMYLOID PEPTIDE.
* THE FILES BELOW CAN BE READ DIRECTLY BY X-PLOR 3.0 (A. T. BRUNGER)
* AFTER REMOVING LINES WITH AN ASTERIX IN COLUMN 1.
* FURTHER INFORMATION ABOUT THE USE OF THESE FILES CAN BE FOUND IN THIS
* REFERENCE: J. TALAFOUS, K. J. MARCINOWSKI, G. KLOPMAN, M. G. ZAGORSKI
* BIOCHEMISTRY 33, 7788-7796, (1994).
* NOTE: DISTANCE RESTRAINTS WITH AN EXCLAMATION MARK IN THE FIRST
* COLUMN (9 IN TOTAL) ARE ARGUABLE IN TERMS OF INTENSITY TO VOLUME
* QUANTITATION OR SPECTRAL ASSIGNMENT AND WERE USED IN THE CALCULATIONS.
*********************************************************************
* X-PLOR 3.0 FILE 1: qualout.tbl
* CONTAINS QUALITATIVE INTERRESIDUE RESTRAINTS (52) THAT ARE
* ESTIMATED BY THE STANDARD CATEGORIZATION METHOD (WUTHRICH, 1986)
;
save_
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