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
582261 2mfv 19573 cing 1-original 1 DYANA/DIANA distance general distance simple 

# CYANA Upper Limit File for molecule named: xanii14dm7p.upl  
# based on NOESY 100 ms in DMSO-d6 at 305 K  
# Atom names according to the convention of cyana.lib 
# Upper limit distances produced by CYANA "caliba bb=1.64E+10"
# bb calculated manually by checking all the methylene peaks
# Partial stereo specific assignment to methylene protons
# done manually
# The stereo specific not assigned methylene protons are
# adjusted with the command "distance modify"
# Use the modified residue GLUP (side chain with a single OE
# for the -C=O) in the library cyana.lib edit by Xie

# Manual Input for proper geometry  
# of side-chain/backbone peptide bond 
  1 GLY  N       7 GLUP CD      1.33  
  1 GLY  N       7 GLUP OE      2.26  
  1 GLY  N       7 GLUP CD      2.41  
  1 GLY  H       7 GLUP CD      2.06  
  1 GLY  CA      7 GLUP CD      2.42  
  1 GLY  H       1 GLY  CA      2.09  
  1 GLY  CA      7 GLUP OE      2.78  
  1 GLY  H       7 GLUP OE      3.17  
# END Manual Input

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