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 |
|
|
33457 |
1icl   |
cing | 2-parsed | STAR | comment |
data_1icl_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1icl
_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_1icl 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1icl
_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 1icl "Master copy" parsed_1icl
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1icl
_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 1icl.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1icl 1
1 1icl.mr . . n/a 2 comment "Not applicable" "Not applicable" 0 parsed_1icl 1
1 1icl.mr . . DISCOVER 3 distance NOE simple 0 parsed_1icl 1
1 1icl.mr . . n/a 4 comment "Not applicable" "Not applicable" 0 parsed_1icl 1
1 1icl.mr . . DISCOVER 5 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_1icl 1
1 1icl.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1icl 1
stop_
save_
save_MR_file_comment_2
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_1icl
_Org_constr_file_comment.ID 1
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 2
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment
;
!BIOSYM restraint 1
!
#remote_prochiral_center
!
#chiral
1:SERN_1:CA S
1:LYS+_2:CA S
1:TYR_3:CA S
1:GLU_4:CA S
1:TYR_5:CA S
1:THR_6:CA S
1:THR_6:CB R
1:VAL_7:CA S
1:PRO_8:CA R
1:SER_9:CA S
1:TYR_10:CA S
1:THR_11:CA S
1:THR_11:CB R
1:PHE_12:CA S
1:ARG+_13:CA S
1:PRO_15:CA S
1:CYS_17:CA R
1:PRO_18:CA S
1:THR_19:CA S
1:THR_19:CB R
1:VAL_20:CA S
1:LYS+_21:CA S
1:PRO_22:CA S
1:ALA_23:CA R
1:ILE_24:CA S
1:ILE_24:CB S
1:SER_25:CA S
1:LEU_26:CA S
1:ARG+_27:CA S
1:CYS_28:CA R
1:GLUC_29:CA S
!
;
save_
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