NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id cing stage position program type
20278 2fey cing 1-original 4 XPLOR/CNS planarity


restraints plane
! G1-C43 WC
!--------------------------------------------------------------------
 group 
  select= ((resid 1 and (name N1 or name C6 or name C2)) or 
  (resid 43 and (name N3))) 
  weight=80 
 end 

 group
  select= ((resid 1 and (name N1)) or
                (resid 43 and (name N3 or name C2 or name C4)))
  weight=80
 end
   
! A2-U42 WC
!--------------------------------------------------------------------
 group
  select= ((resid 2 and (name N1 or name C2 or name C6)) or
  (resid 42 and (name N3)))
  weight=50 
 end   

 group
  select= ((resid 2 and (name N1)) or
                (resid 42 and (name N3 or name C2 or name C4)))
  weight=50
 end
   
! G3-C41 WC
!--------------------------------------------------------------------
 group
  select= ((resid 3 and (name N1 or name C6 or name C2)) or
  (resid 41 and (name N3)))
  weight=50 
 end  

 group
  select= ((resid 3 and (name N1)) or
                (resid 41 and (name N3 or name C2 or name C4)))
  weight=50
 end
   
! A4-U40 WC
!--------------------------------------------------------------------
 group
  select= ((resid 4 and (name N1 or name C2 or name C6)) or
  (resid 40 and (name N3)))
  weight=50 
 end   

 group
  select= ((resid 4 and (name N1)) or
                (resid 40 and (name N3 or name C2 or name C4)))
  weight=50
 end

! C5-G39 WC
!--------------------------------------------------------------------
 group
  select= ((resid 39 and (name N1 or name C6 or name C2)) or
  (resid 5 and (name N3)))
  weight=50 
 end

 group
  select= ((resid 39 and (name N1)) or
                (resid 5 and (name N3 or name C2 or name C4)))
  weight=50
 end

! A7-U38 WC
!--------------------------------------------------------------------
! group
!  select= ((resid 7 and (name N1 or name C2 or name C6)) or
!  (resid 38 and (name N3)))
!  weight=20 
! end   

! group
!  select= ((resid 7 and (name N1)) or
!                (resid 38 and (name N3 or name C2 or name C4)))
!  weight=20
! end

! U8-A37 WC
!--------------------------------------------------------------------
! group
!  select= ((resid 37 and (name N1)) or
!  (resid 8 and (name N3 or name C2 or name C4)))
!  weight=20 
! end   

! group
!  select= ((resid 37 and (name N1 or name C2 or name C6)) or
!                (resid 8 and (name N3)))
!  weight=20
! end

! C9-G36 WC
!--------------------------------------------------------------------
 group
  select= ((resid 36 and (name N1 or name C6 or name C2)) or
   (resid 9 and (name N3)))
  weight=20 
 end
 
 group
  select= ((resid 36 and (name N1)) or
                (resid 9 and (name N3 or name C2 or name C4)))
  weight=20
 end

! C12-G35 WC
!--------------------------------------------------------------------
 group
  select= ((resid 35 and (name N1 or name C6 or name C2)) or
  (resid 12 and (name N3)))
  weight=50 
 end

 group
  select= ((resid 35 and (name N1)) or
                (resid 12 and (name N3 or name C2 or name C4)))
  weight=50
 end
   
! A13-U34 WC
!--------------------------------------------------------------------
 group
  select= ((resid 13 and (name N1 or name C2 or name C6)) or
  (resid 34 and (name N3)))
  weight=50 
 end   

 group
  select= ((resid 13 and (name N1)) or
                (resid 34 and (name N3 or name C2 or name C4)))
  weight=50
 end

! U14-A33 WC
!--------------------------------------------------------------------
 group
  select= ((resid 33 and (name N1)) or
  (resid 14 and (name N3 or name C2 or name C4)))
  weight=30 
 end   

 group
  select= ((resid 33 and (name N1 or name C2 or name C6)) or
                (resid 14 and (name N3)))
  weight=30
 end

! G17-C31 WC
!--------------------------------------------------------------------
 group
  select= ((resid 17 and (name N1)) or
  (resid 31 and (name N3 or name C2 or name C4)))
  weight=50 
 end 

 group
  select= ((resid 17 and (name N1 or name C6 or name C2)) or
                (resid 31 and (name N3)))
  weight=50
 end  

! A18-U30 WC
!--------------------------------------------------------------------
 group
  select= ((resid 18 and (name N1)) or
  (resid 30 and (name N3 or name C2 or name C4)))
  weight=50
 end

 group
  select= ((resid 18 and (name N1 or name C2 or name C6)) or
                (resid 30 and (name N3)))
  weight=50
 end

! U19-A29 WC
!--------------------------------------------------------------------
 group
  select= ((resid 29 and (name N1)) or
   (resid 19 and (name N3 or name C2 or name C4)))
  weight=50 
 end   

 group
  select= ((resid 29 and (name N1 or name C2 or name C6)) or
                (resid 19 and (name N3)))
  weight=50
 end

! A20-U28 WC
!--------------------------------------------------------------------
 group
  select= ((resid 20 and (name N1)) or
  (resid 28 and (name N3 or name C2 or name C4)))
  weight=30 
 end

 group
  select= ((resid 20 and (name N1 or name C2 or name C6)) or
                (resid 28 and (name N3)))
  weight=30
 end

end


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