Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype |
|
|
35084 | 1kx2 RC | 5304 | cing | 2-parsed | STAR | entry | full |
data_1kx2_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1kx2
_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_1kx2 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1kx2
_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 1kx2 "Master copy" parsed_1kx2
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1kx2
_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 1kx2.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1kx2 1
1 1kx2.mr . . n/a 2 "chemical shift" "Not applicable" "format 3" 0 parsed_1kx2 1
1 1kx2.mr . . n/a 3 comment "Not applicable" "Not applicable" 0 parsed_1kx2 1
1 1kx2.mr . . unknown 4 "chemical shift" "Not applicable" "Not applicable" 0 parsed_1kx2 1
1 1kx2.mr . . n/a 5 comment "Not applicable" "Not applicable" 0 parsed_1kx2 1
1 1kx2.mr . . unknown 6 distance NOE simple 0 parsed_1kx2 1
1 1kx2.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1kx2 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_1kx2
_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 OXYGEN STORAGE/TRANSPORT 30-JAN-02 1KX2
*TITLE MINIMIZED AVERAGE STRUCTURE OF A MONO-HEME FERROCYTOCHROME
*TITLE 2 C FROM SHEWANELLA PUTREFACIENS
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: MONO-HEME C-TYPE CYTOCHROME SCYA;
*COMPND 3 CHAIN: A;
*COMPND 4 SYNONYM: MONO-HEME FERROCYTOCHROME C;
*COMPND 5 ENGINEERED: YES
*SOURCE MOL_ID: 1;
*SOURCE 2 ORGANISM_SCIENTIFIC: SHEWANELLA PUTREFACIENS;
*SOURCE 3 ORGANISM_COMMON: BACTERIA;
*SOURCE 4 GENE: SCYA;
*SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
*SOURCE 6 EXPRESSION_SYSTEM_COMMON: BACTERIA;
*SOURCE 7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3)C41;
*SOURCE 8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;
*SOURCE 9 EXPRESSION_SYSTEM_PLASMID: PPB10SCYA
*KEYWDS HAEM PROTEIN, FERROCYTOCHROME, ELECTRON TRANSPORT, GRAM
*KEYWDS 2 NEGATIVE, BACTERIA, SCYA SHEWANELLA PUTREFACIENS, MONO HAEM,
*KEYWDS 3 ALL-ALPHA
*EXPDTA NMR, MINIMIZED AVERAGE STRUCTURE
*AUTHOR I.BARTALESI, I.BERTINI, P.HAJIEVA, A.ROSATO, P.R.VASOS
*REVDAT 1 13-FEB-02 1KX2 0
Table 1: 15N and 1HNMR chemical shifts of amino acid residues in the reduced cytochrome c from
Shewanella putrefaciens (T=298 K).
Notations a, b, g, d, e stand respectively for alpha, beta, gamma, epsilon
-CH3 stands for a methyl group corresponding to the frequency
-N for a nitrogen frequency assignment
Res Nr. N HN Ha Hb Others
;
save_
save_MR_file_comment_3
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_1kx2
_Org_constr_file_comment.ID 2
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 3
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment
;
Heme Assignments
;
save_
save_MR_file_comment_5
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_1kx2
_Org_constr_file_comment.ID 3
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 5
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment
;
Table 2: NOEs
Atom 1 Atom 2 dist
;
save_