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 | subtype |
|
|
596979 |
2n5r   |
25726 | cing | 2-parsed | STAR | entry | full |
data_2n5r_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2n5r
_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_2n5r 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2n5r
_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 2n5r "Master copy" parsed_2n5r
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2n5r
_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 2n5r.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2n5r 1
1 2n5r.mr . . DYANA/DIANA 2 distance NOE simple 0 parsed_2n5r 1
1 2n5r.mr . . "MR format" 3 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2n5r 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_2n5r
_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 APOPTOSIS 24-JUL-15 2N5R
*TITLE NMR STRUCTURE OF CFLIP-DERIVED CALMODULIN BINDING PEPTIDE
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: CASP8 AND FADD-LIKE APOPTOSIS REGULATOR;
*COMPND 3 CHAIN: A;
*COMPND 4 FRAGMENT: DED 1 DOMAIN RESIDUES 62-73;
*COMPND 5 SYNONYM: CASPASE HOMOLOG, CASH, CASPASE-EIGHT-RELATED PROTEIN,
*COMPND 6 CASPER, CASPASE-LIKE APOPTOSIS REGULATORY PROTEIN, CLARP, CELLULAR
*COMPND 7 FLICE-LIKE INHIBITORY PROTEIN, C-FLIP, FADD-LIKE ANTIAPOPTOTIC
*COMPND 8 MOLECULE 1, FLAME-1, INHIBITOR OF FLICE, I-FLICE, MACH-RELATED
*COMPND 9 INDUCER OF TOXICITY, MRIT, USURPIN, CASP8 AND FADD-LIKE APOPTOSIS
*COMPND 10 REGULATOR SUBUNIT P43, CASP8 AND FADD-LIKE APOPTOSIS REGULATOR
*COMPND 11 SUBUNIT P12;
*COMPND 12 ENGINEERED: YES
*SOURCE MOL_ID: 1;
*SOURCE 2 SYNTHETIC: YES;
*SOURCE 3 ORGANISM_SCIENTIFIC: HOMO SAPIENS;
*SOURCE 4 ORGANISM_COMMON: HUMAN;
*SOURCE 5 ORGANISM_TAXID: 9606
*KEYWDS CALMODULIN, APOPTOSIS
*EXPDTA SOLUTION NMR
*NUMMDL 21
*AUTHOR A.E.PANAITIU
*REVDAT 1 18-NOV-15 2N5R 0
;
save_
save_DYANA/DIANA_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2n5r
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 2
_Distance_constraint_list.Details "Generated by Wattos"
loop_
_Dist_constraint_parse_err.ID
_Dist_constraint_parse_err.Content
_Dist_constraint_parse_err.Begin_line
_Dist_constraint_parse_err.Begin_column
_Dist_constraint_parse_err.End_line
_Dist_constraint_parse_err.End_column
_Dist_constraint_parse_err.Entry_ID
_Dist_constraint_parse_err.Distance_constraint_list_ID
1
;
QCONVR conversion noe distance restraints from /home/ap/dg/DED1_R4/run5/R4-NOElist-DIANA.noe
count 87 type diana
NOEUPP ARG 2 HA ARG 3 H 3.150
NOEUPP ARG 3 HA ARG 3 H 4.170
NOEUPP ARG 3 HA PHE 4 H 2.990
NOEUPP ARG 3 HA ASP 5 H 4.400
NOEUPP ARG 3 HA LEU 6 H 3.400
NOEUPP ARG 3 QB ARG 3 H 4.110
NOEUPP ARG 3 QB PHE 4 H 4.120
NOEUPP ARG 3 QB ASP 5 H 4.300
NOEUPP ARG 3 QG ARG 3 H 4.910
NOEUPP ARG 3 QG PHE 4 HZ 3.000
NOEUPP PHE 4 HA PHE 4 CG 2.870
NOEUPP PHE 4 HA PHE 4 CZ 3.680
NOEUPP PHE 4 HA PHE 4 H 2.940
NOEUPP PHE 4 HA ASP 5 H 2.960
NOEUPP PHE 4 HA LEU 6 H 4.400
NOEUPP PHE 4 QB PHE 4 CG 2.780
NOEUPP PHE 4 QB PHE 4 CZ 3.340
NOEUPP PHE 4 QB PHE 4 H 3.360
NOEUPP PHE 4 QB ASP 5 H 3.540
NOEUPP PHE 4 QB LEU 6 H 4.080
NOEUPP PHE 4 QB PHE 4 QB 1.960
NOEUPP PHE 4 QB PHE 4 CG 2.730
NOEUPP PHE 4 QB PHE 4 CZ 3.410
NOEUPP PHE 4 QB PHE 4 H 3.260
NOEUPP PHE 4 QB ASP 5 H 3.560
NOEUPP PHE 4 CG PHE 4 H 3.850
NOEUPP PHE 4 CG ASP 5 H 3.880
NOEUPP PHE 4 H ARG 3 H 3.290
NOEUPP ASP 5 HA PHE 4 CG 4.260
NOEUPP ASP 5 HA ASP 5 H 3.000
NOEUPP ASP 5 HA LEU 6 H 2.750
NOEUPP ASP 5 HA LYS 8 H 3.600
NOEUPP ASP 5 QB ASP 5 H 3.570
NOEUPP ASP 5 QB LEU 6 H 3.920
NOEUPP ASP 5 QB LYS 8 H 4.700
NOEUPP LEU 6 HA LEU 6 H 2.690
NOEUPP LEU 6 HA LEU 7 H 2.940
NOEUPP LEU 6 HA LYS 8 H 4.400
NOEUPP LEU 6 HA ILE 10 H 4.850
NOEUPP LEU 6 QD PHE 4 CG 4.110
NOEUPP LEU 6 QD LEU 6 H 4.070
NOEUPP LEU 6 H PHE 4 H 4.200
NOEUPP LEU 6 H ASP 5 H 3.230
NOEUPP LEU 7 HA LEU 7 H 3.850
NOEUPP LEU 7 HA LYS 8 H 4.760
NOEUPP LEU 7 QB PHE 4 CZ 3.940
NOEUPP LEU 7 QB LEU 7 H 4.220
NOEUPP LEU 7 QB ILE 10 H 4.160
NOEUPP LEU 7 MD1 PHE 4 CG 4.300
NOEUPP LEU 7 MD1 PHE 4 CZ 4.310
NOEUPP LEU 7 MD1 PHE 4 HZ 4.450
NOEUPP LEU 7 MD2 PHE 4 CG 4.360
NOEUPP LEU 7 MD2 PHE 4 HZ 4.400
NOEUPP LEU 7 HG LEU 7 H 3.650
NOEUPP LYS 8 HA LYS 8 H 2.770
NOEUPP LYS 8 QB LYS 8 H 3.860
NOEUPP LYS 8 QD LYS 8 H 3.520
NOEUPP LYS 8 HG2 LYS 8 H 3.310
NOEUPP LYS 8 HG3 LYS 8 H 3.590
NOEUPP LYS 8 H LEU 7 H 3.080
NOEUPP ARG 9 HA LYS 12 H 3.950
NOEUPP ARG 9 QB ARG 9 H 3.440
NOEUPP ILE 10 HA ILE 10 H 3.620
NOEUPP ILE 10 HA LEU 11 H 3.060
NOEUPP ILE 10 HB ILE 10 H 3.310
NOEUPP ILE 10 HB LEU 11 H 3.640
NOEUPP ILE 10 MD ILE 10 H 4.970
NOEUPP ILE 10 HG12 ILE 10 H 3.450
NOEUPP ILE 10 HG13 ILE 10 H 3.480
NOEUPP ILE 10 H LEU 11 H 2.820
NOEUPP LEU 11 HA LEU 11 H 3.500
NOEUPP LEU 11 HA LYS 12 H 2.750
NOEUPP LEU 11 QB LEU 11 H 3.540
NOEUPP LEU 11 QB LYS 12 H 4.080
NOEUPP LEU 11 MD1 LEU 11 H 4.120
NOEUPP LEU 11 MD1 LYS 12 H 4.900
NOEUPP LEU 11 MD2 LYS 12 H 5.460
NOEUPP LYS 12 HA LYS 12 H 3.020
NOEUPP LYS 12 QB LYS 12 H 4.420
NOEUPP LYS 12 QD LYS 12 H 4.140
NOEUPP LYS 12 QG LYS 12 H 4.630
NOEUPP LYS 12 H ILE 10 H 4.200
NOEUPP LYS 12 H LEU 11 H 3.650
NOEUPP ARG 2 HA ARG 2 QB 3.410
NOEUPP ARG 2 HA ARG 2 QD 2.980
NOEUPP ARG 3 H ASP 5 H 4.100
NOEUPP PHE 4 H LEU 6 H 3.970
;
1 1 89 48 parsed_2n5r 1
stop_
save_
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