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
144012 2kmj 16431 cing 1-original 5 XPLOR/CNS planarity


! file: plane.dat
! Planar restraints to maintain base pair planarity
! PBM from A. Szewczak
! LAST UPDATE: 6/7/93
!updated for u2a 12/2/96 

! NOTE: $PSCALE MUST BE DEFINED WITHIN THIS FILE OR IN EACH PROTOCOL!
! OTHERWISE THE DEFAULT IS: 300kcal/mol/A^2

evaluate ($pscale =100)  {was 50}


! G17-U45 Wobble
!--------------------------------------------------------------------
restraints plane
group
selection=     ((segid A and segid A and resid 17 and name N1) or (segid A and segid A and resid 17 and name N3) or
  (segid A and segid A and resid 17 and name C5) or (segid A and segid A and resid 45 and name N1) or
   (segid A and segid A and resid 45 and name N3) or (segid A and segid A and resid 45 and name C5))
weight = $pscale end


! C18-G44 WC
!--------------------------------------------------------------------
group
selection=     ((segid A and segid A and resid 18 and name N1) or (segid A and resid 18 and name N3) or
  (segid A and resid 18 and name C5) or (segid A and resid 44 and name N1) or
   (segid A and resid 44 and name N3) or (segid A and resid 44 and name C5))
weight = $pscale end

! C19-G43 WC
!--------------------------------------------------------------------
group
selection=     ((segid A and resid 19 and name N1) or (segid A and resid 19 and name N3) or
  (segid A and resid 19 and name C5) or (segid A and resid 43 and name N1) or
   (segid A and resid 43 and name N3) or (segid A and resid 43 and name C5))
weight = $pscale end

! A20-U42 WC
!--------------------------------------------------------------------
group
selection=     ((segid A and resid 20 and name N1) or (segid A and resid 20 and name N3) or
  (segid A and resid 20 and name C5) or (segid A and resid 42 and name N1) or
   (segid A and resid 42 and name N3) or (segid A and resid 42 and name C5))
weight = $pscale end

! G21-C41 WC
!--------------------------------------------------------------------
group
selection=     ((segid A and resid 21 and name N1) or (segid A and resid 21 and name N3) or
  (segid A and resid 21 and name C5) or (segid A and resid 41 and name N1) or
   (segid A and resid 41 and name N3) or (segid A and resid 41 and name C5))
weight = $pscale end

! A22-U40 WC
!--------------------------------------------------------------------
group
selection=     ((segid A and resid 22 and name N1) or (segid A and resid 22 and name N3) or
  (segid A and resid 22 and name C5) or (segid A and resid 40 and name N1) or
   (segid A and resid 40 and name N3) or (segid A and resid 40 and name C5))
weight = $pscale end

! G26-C39 WC
!--------------------------------------------------------------------
group
selection=     ((segid A and resid 26 and name N1) or (segid A and resid 26 and name N3) or
  (segid A and resid 26 and name C5) or (segid A and resid 39 and name N1) or
   (segid A and resid 39 and name N3) or (segid A and resid 39 and name C5))
weight = $pscale end

! A27-U38 WC
!--------------------------------------------------------------------
group
selection=     ((segid A and resid 27 and name N1) or (segid A and resid 27 and name N3) or
  (segid A and resid 27 and name C5) or (segid A and resid 38 and name N1) or
   (segid A and resid 38 and name N3) or (segid A and resid 38 and name C5))
weight = $pscale end

! G28-C37 WC
!--------------------------------------------------------------------
group
selection=     ((segid A and resid 28 and name N1) or (segid A and resid 28 and name N3) or
  (segid A and resid 28 and name C5) or (segid A and resid 37 and name N1) or
   (segid A and resid 37 and name N3) or (segid A and resid 37 and name C5))
weight = $pscale end

! C29-G36 WC
!--------------------------------------------------------------------
group
selection=     ((segid A and resid 29 and name N1) or (segid A and resid 29 and name N3) or
  (segid A and resid 29 and name C5) or (segid A and resid 36 and name N1) or
   (segid A and resid 36 and name N3) or (segid A and resid 36 and name C5))
weight = $pscale end


end


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