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 |
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|
50872 |
2k3u   |
15778 | cing | 2-parsed | STAR | comment |
data_2k3u_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2k3u
_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_2k3u 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2k3u
_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 2k3u "Master copy" parsed_2k3u
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2k3u
_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 2k3u.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2k3u 1
1 2k3u.mr . . XPLOR/CNS 2 distance NOE ambi 0 parsed_2k3u 1
1 2k3u.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 0 parsed_2k3u 1
1 2k3u.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_2k3u 1
1 2k3u.mr . . XPLOR/CNS 5 distance NOE ambi 0 parsed_2k3u 1
1 2k3u.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2k3u 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_2k3u
_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 IMMUNE SYSTEM 16-MAY-08 2K3U
*TITLE STRUCTURE OF THE TYROSINE-SULFATED C5A RECEPTOR N-TERMINUS
*TITLE 2 IN COMPLEX WITH THE IMMUNE EVASION PROTEIN CHIPS.
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: CHEMOTAXIS INHIBITORY PROTEIN;
*COMPND 3 CHAIN: A;
*COMPND 4 FRAGMENT: CHEMOTAXIS INHIBITING PROTEIN CHIPS(59-149).;
*COMPND 5 SYNONYM: CHIPS;
*COMPND 6 ENGINEERED: YES;
*COMPND 7 MOL_ID: 2;
*COMPND 8 MOLECULE: C5AR(P7-28S) PEPTIDE;
*COMPND 9 CHAIN: B;
*COMPND 10 FRAGMENT: C5AR(P7-28S);
*COMPND 11 ENGINEERED: YES
*SOURCE MOL_ID: 1;
*SOURCE 2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS AUREUS SUBSP. AUREUS
*SOURCE 3 STR. NEWMAN;
*SOURCE 4 ORGANISM_TAXID: 426430;
*SOURCE 5 GENE: CHP, NWMN_1877;
*SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
*SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562;
*SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21;
*SOURCE 9 EXPRESSION_SYSTEM_VARIANT: DE3;
*SOURCE 10 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;
*SOURCE 11 EXPRESSION_SYSTEM_PLASMID: PRSET B;
*SOURCE 12 MOL_ID: 2;
*SOURCE 13 SYNTHETIC: YES;
*SOURCE 14 OTHER_DETAILS: FMOC/TBU-BASED PEPTIDE SYNTHESIS. SULFATED
*SOURCE 15 TYROSINES 11 AND 14 WERE INTRODUCED AS FMOC-2-CHLOROTRITYL
*SOURCE 16 PROTECTED BUILDING BLOCKS.
*KEYWDS CHEMOTAXIS INHIBITORY PROTEIN (CHIPS), SULFATED TYROSINE,
*KEYWDS 2 GPCR MEMBRANE PROTEIN C5AR, ANAPHYLOTOXIN C5A,
*KEYWDS 3 STAPHYLOCOCCUS AUREUS, COMPLEMENT CASCADE, SECRETED,
*KEYWDS 4 VIRULENCE, IMMUNE SYSTEM
*EXPDTA SOLUTION NMR
*NUMMDL 25
*AUTHOR J.H.IPPEL, A.BUNSCHOTEN, J.KEMMINK, R.LISKAMP
*REVDAT 1 10-MAR-09 2K3U 0
;
save_
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