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
547345 2lwk 18633 cing 1-original 4 XPLOR/CNS planarity


! planarity restraints
! A2-U32 WC
!--------------------------------------------------------------------
 group
  select= ((resid 2 and (name N1 or name C2 or name C6)) or
  (resid 32 and (name N3)))
  weight=100 
 end   

 group
  select= ((resid 2 and (name N1)) or
                (resid 32 and (name N3 or name C2 or name C4)))
  weight=100
 end

! G3-C31 WC
!--------------------------------------------------------------------
 group 
  select= ((resid 3 and (name N1 or name C6 or name C2)) or 
  (resid 31 and (name N3))) 
  weight=100 
 end 

 group
  select= ((resid 3 and (name N1)) or
                (resid 31 and (name N3 or name C2 or name C4)))
  weight=100 
 end



! A5-U29 WC
!--------------------------------------------------------------------
 group
  select= ((resid 5 and (name N1 or name C2 or name C6)) or
  (resid 29 and (name N3)))
  weight=50 
 end   

 group
  select= ((resid 5 and (name N1)) or
                (resid 29 and (name N3 or name C2 or name C4)))
  weight=50
 end

! G6-U28  wobble
!--------------------------------------------------------------------
 group
  select= ((resid 6 and (name N1 or name C6 or name C2)) or
           (resid 28 and (name N3)))
  weight=50 
 end   

 group
  select= ((resid 6 and (name N1)) or
                (resid 28 and (name N3 or name C2 or name C4)))
  weight=50
 end

! A7-U27 WC
!--------------------------------------------------------------------
 group
  select= ((resid 7 and (name N1 or name C2 or name C6)) or
  (resid 27 and (name N3)))
  weight=100 
 end   

 group
  select= ((resid 7 and (name N1)) or
                (resid 27 and (name N3 or name C2 or name C4)))
  weight=100
end

! A8-U26 WC
!--------------------------------------------------------------------
 group
  select= ((resid 8 and (name N1 or name C2 or name C6)) or
  (resid 26 and (name N3)))
  weight=100 
 end   

 group
  select= ((resid 8 and (name N1)) or
                (resid 26 and (name N3 or name C2 or name C4)))
  weight=100
 end

! A9-C25  mismatch
!--------------------------------------------------------------------
 group
  select= ((resid 9 and (name N3 or name C2 or name N1)) or
  (resid 25 and (name C5)))
  weight=100 
 end   

 group
  select= ((resid 9 and (name N1)) or
                (resid 25 and (name N3 or name C5 or name C4)))
  weight=100
 end



! G24-C10 WC
!--------------------------------------------------------------------
 group 
  select= ((resid 24 and (name N1 or name C6 or name C2)) or 
  (resid 10 and (name N3))) 
  weight=100 
 end 

 group
  select= ((resid 24 and (name N1)) or
                (resid 10 and (name N3 or name C2 or name C4)))
  weight=100
 end


! G13-C22 WC
!--------------------------------------------------------------------
 group 
  select= ((resid 13 and (name N1 or name C6 or name C2)) or 
  (resid 22 and (name N3))) 
  weight=150 
 end 

 group
  select= ((resid 13 and (name N1)) or
                (resid 22 and (name N3 or name C2 or name C4)))
  weight=150
 end

! G14-C21 WC
!--------------------------------------------------------------------
 group 
  select= ((resid 14 and (name N1 or name C6 or name C2)) or 
  (resid 21 and (name N3))) 
  weight=150 
 end 

 group
  select= ((resid 14 and (name N1)) or
                (resid 21 and (name N3 or name C2 or name C4)))
  weight=150
 end

! C15-G20 WC
!--------------------------------------------------------------------
 group
  select= ((resid 20 and (name N1 or name C6 or name C2)) or
  (resid 15 and (name N3)))
  weight=150 
 end

 group
  select= ((resid 20 and (name N1)) or
                (resid 15 and (name N3 or name C2 or name C4)))
  weight=150
 end



end








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