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
621830 5j7j 30062 cing 1-original 1 XPLOR/CNS distance NOE simple 

# Restraints file 1: IntermolecularNOE_Data.txt
!!! segid A: Calmodulin
!!! segid B: PSD95 (1-19)


assign (segid B and resid   1 and   name HA   )(segid B and resid   4 and   name HB  )  0.0 0.0 2.5
assign (segid B and resid   2 and   name HA   )(segid B and resid   5 and   name HB  )  0.0 0.0 2.5
assign (segid B and resid   3 and   name HA   )(segid B and resid   6 and   name HB  )  0.0 0.0 2.5
assign (segid B and resid   4 and   name HA   )(segid B and resid   7 and   name HB  )  0.0 0.0 2.5
assign (segid B and resid   5 and   name HA   )(segid B and resid   8 and   name HB  )  0.0 0.0 2.5
assign (segid B and resid   6 and   name HA   )(segid B and resid   9 and   name HB  )  0.0 0.0 2.5
assign (segid B and resid   7 and   name HA   )(segid B and resid   10 and   name HB#  )  0.0 0.0 2.5
assign (segid B and resid   8 and   name HA   )(segid B and resid   11 and   name HB#  )  0.0 0.0 2.5
assign (segid B and resid   9 and   name HA   )(segid B and resid   12 and   name HB#  )  0.0 0.0 2.5
assign (segid B and resid   10 and   name HA   )(segid B and resid  13 and   name HB#  )  0.0 0.0 2.5

!!!    
assign (segid A and resid 115 and name HZ# ) (segid B and resid 19 and name O2P )  2.0 2.0 0.0

!!! 

assign (segid A and resid 126 and name NH# ) (segid B and resid 17 and name OE# )  2.0 2.0 0.0

assign (segid A and resid 147 and name OXT) (segid B and resid 15 and name HE2# ) 2.0 2.0 0.0

assign (segid A and resid 147 and name O) (segid B and resid 15 and name HE2#) 2.0 2.0 0.0

!!! M124(CaM) - Y12(PSD)

assign (segid A and resid 124 and name CG ) (segid B and resid 12 and name HH   )  2.0 2.0 0.0
assign (segid A and resid 124 and name CE ) (segid B and resid 12 and name CE1  )  2.0 2.0 0.0
assign (segid A and resid 124 and name CE ) (segid B and resid 12 and name CD1  )  2.0 2.0 0.0


!!! V136(CaM) - Y12(PSD)
assign (segid A and resid 136 and name HG# ) (segid B and resid 12 and name OH  )  2.0 2.0 0.0

!!! M141(CaM) - Y12(PSD)
assign (segid A and resid 141 and name CE2 ) (segid B and resid 12 and name CD2 )  2.0 2.0 0.0
assign (segid A and resid 141 and name CD2 ) (segid B and resid 12 and name CD2 )  2.0 2.0 0.0
assign (segid A and resid 141 and name CD2 ) (segid B and resid 12 and name CE2 )  2.0 2.0 0.0
assign (segid A and resid 141 and name CE2 ) (segid B and resid 12 and name CE2 )  2.0 2.0 0.0

!!! M144(CaM) - Y12(PSD)
assign (segid A and resid 144 and name CE ) (segid B and resid 12 and name CE2  )  2.0 2.0 0.0
assign (segid A and resid 144 and name CE ) (segid B and resid 12 and name CD2  )  2.0 2.0 0.0

!!! V55(CaM) - C3(PSD) 
assign (segid A and resid 55 and name HG2# ) (segid B and resid 3 and name HG  )  2.0 2.0 0.0

!!! I63(CaM) - C3(PSD) 
assign (segid A and resid 63 and name HD1# ) (segid B and resid 3 and name HG  )  2.0 2.0 0.0
assign (segid A and resid 63 and name HG2# ) (segid B and resid 3 and name HG  )  2.0 2.0 0.0
assign (segid A and resid 63 and name HG1# ) (segid B and resid 3 and name HG  )  2.0 2.0 0.0
assign (segid A and resid 63 and name HB ) (segid B and resid 3 and name HG  )  2.0 2.0 0.0

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