NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type |
|
|
50861 |
2k3r   |
15776 | cing | 2-parsed | STAR | dipolar coupling |
data_2k3r_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2k3r
_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_2k3r 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2k3r
_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 2k3r "Master copy" parsed_2k3r
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2k3r
_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 2k3r.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2k3r 1
1 2k3r.mr . . XPLOR/CNS 2 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2k3r 1
1 2k3r.mr . . "MR format" 3 comment "Not applicable" "Not applicable" 0 parsed_2k3r 1
1 2k3r.mr . . XPLOR/CNS 4 distance "hydrogen bond" simple 0 parsed_2k3r 1
1 2k3r.mr . . XPLOR/CNS 5 distance NOE simple 0 parsed_2k3r 1
1 2k3r.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2k3r 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_2
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2k3r
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 2
_RDC_constraint_list.Details "Generated by Wattos"
loop_
_RDC_constraint_parse_err.ID
_RDC_constraint_parse_err.Content
_RDC_constraint_parse_err.Begin_line
_RDC_constraint_parse_err.Begin_column
_RDC_constraint_parse_err.End_line
_RDC_constraint_parse_err.End_column
_RDC_constraint_parse_err.Entry_ID
_RDC_constraint_parse_err.RDC_constraint_list_ID
1
;
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;
3 1 7 32 parsed_2k3r 1
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;
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;
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;
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87 1 91 32 parsed_2k3r 1
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;
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;
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117 1 121 34 parsed_2k3r 1
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123 1 127 32 parsed_2k3r 1
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129 1 133 33 parsed_2k3r 1
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;
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;
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;
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;
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;
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;
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;
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;
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;
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;
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;
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;
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;
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;
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;
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;
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;
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;
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;
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;
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;
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;
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;
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;
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;
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;
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;
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;
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;
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;
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;
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;
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;
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;
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;
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;
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;
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;
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447 1 451 32 parsed_2k3r 1
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;
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;
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;
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;
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;
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;
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;
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;
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;
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;
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;
507 1 511 32 parsed_2k3r 1
86
;
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;
513 1 517 32 parsed_2k3r 1
87
;
assign (resid 500 and name OO)
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(resid 41 and name HN) 0.74 0.100
;
519 1 523 33 parsed_2k3r 1
88
;
assign (resid 500 and name OO)
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(resid 41 and name N) 1.1 0.100
;
525 1 529 31 parsed_2k3r 1
89
;
assign (resid 500 and name OO)
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;
531 1 535 32 parsed_2k3r 1
90
;
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;
537 1 541 33 parsed_2k3r 1
91
;
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;
543 1 547 32 parsed_2k3r 1
92
;
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;
549 1 553 31 parsed_2k3r 1
93
;
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;
555 1 559 32 parsed_2k3r 1
94
;
assign (resid 500 and name OO)
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;
561 1 565 31 parsed_2k3r 1
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123
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136
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137
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142
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144
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145
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146
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147
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148
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150
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152
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153
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154
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155
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156
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157
;
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158
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159
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160
;
assign (resid 500 and name OO)
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161
;
assign (resid 500 and name OO)
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162
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163
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assign (resid 500 and name OO)
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164
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assign (resid 500 and name OO)
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165
;
assign (resid 500 and name OO)
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987 1 991 32 parsed_2k3r 1
166
;
assign (resid 500 and name OO)
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993 1 997 32 parsed_2k3r 1
167
;
assign (resid 500 and name OO)
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999 1 1003 33 parsed_2k3r 1
168
;
assign (resid 500 and name OO)
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1005 1 1009 31 parsed_2k3r 1
169
;
assign (resid 500 and name OO)
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;
1011 1 1015 32 parsed_2k3r 1
stop_
save_
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