NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)
image mrblock_id pdb_id bmrb_id cing stage position program type subtype subsubtype
602067 5iay 30019 cing 1-original 1 XPLOR/CNS distance hydrogen bond simple 

# Restraints file 1: inter_Hbnd.tbl
! inter-Hbnd

! K648 - D190

assign (segid PBR and resid  648 and name hz#) (segid TTD and resid  190 and name od#) 2.0 0.4 0.5
assign (segid PBR and resid  648 and name nz ) (segid TTD and resid  190 and name od#) 3.0 0.8 0.5

assign (segid PBR and resid  648 and name hz#) (segid TTD and resid  190 and name n) 2.0 0.4 0.5
assign (segid PBR and resid  648 and name nz ) (segid TTD and resid  190 and name n) 3.0 0.8 0.5


! R649 - D142

assign (segid PBR and resid  649 and name hh1#) (segid TTD and resid  142 and name od#) 2.0 0.4 0.5
assign (segid PBR and resid  649 and name nh1 ) (segid TTD and resid  142 and name od#) 3.0 0.8 0.5

assign (segid PBR and resid  649 and name hh2#) (segid TTD and resid  142 and name od#) 2.0 0.4 0.5
assign (segid PBR and resid  649 and name nh2 ) (segid TTD and resid  142 and name od#) 3.0 0.8 0.5

! R649 - E153

assign (segid PBR and resid  649 and name hn) (segid TTD and resid  153 and name oe1) 2.0 0.4 0.5
assign (segid PBR and resid  649 and name n ) (segid TTD and resid  153 and name oe1) 3.0 0.8 0.5

assign (segid PBR and resid  649 and name hn) (segid TTD and resid  153 and name oe2) 2.0 0.4 0.5
assign (segid PBR and resid  649 and name n ) (segid TTD and resid  153 and name oe2) 3.0 0.8 0.5


! K650 - W238

assign (segid PBR and resid  650 and name o) (segid TTD and resid  238 and name he1) 2.0 0.4 0.5
assign (segid PBR and resid  650 and name o) (segid TTD and resid  238 and name ne1 ) 3.0 0.8 0.5


! S651 - W238

assign (segid PBR and resid  651 and name hg) (segid TTD and resid  238 and name ne1) 2.0 0.4 0.5
assign (segid PBR and resid  651 and name og) (segid TTD and resid  238 and name ne1) 3.0 0.8 0.5


! A652 - G236

assign (segid PBR and resid  652 and name o) (segid TTD and resid  236 and name hn) 2.0 0.4 0.5
assign (segid PBR and resid  652 and name o) (segid TTD and resid  236 and name n ) 3.0 0.8 0.5

Please acknowledge these references in publications where the data from this site have been utilized.

Contact the webmaster for help, if required. Sunday, June 16, 2024 3:01:44 PM GMT (wattos1)