NMR Restraints Grid

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

image mrblock_id pdb_id cing stage position program type
27381 2rlu cing 1-original 3 XPLOR/CNS dihedral angle


!dihedral angles for SECIS - MT hairpin

!alpha 1.0 -62.0 30.0 2            n O5'    -->   n C5' 
!beta 1.0 -180.0 30.0 2            n C5'    -->   n C4'
!gamma 1.0 47.0 30.0 2             n C4'    -->   n C3' 
!epsilon 1.0 -152.0 30.0 2         n O3'    -->   (n+1) P 
!zeta 1.0 -74.0 30.0 2             (n+1) P  -->   (n+1) O5'  

!assign (resid 0 and name O3') (resid 1 and name P)
 !(resid 1 and name O5') (resid 1 and name C5') 1.0 -62.0 30.0 2
!assign (resid 1 and name P) (resid 1 and name O5')
! (resid 1 and name C5') (resid 1 and name C4') 1.0 -180.0 30.0 2
assign (resid 1 and name O5') (resid 1 and name C4')
 (resid 1 and name C4') (resid 1 and name C3') 1.0 47.0 30.0 2
assign (resid 1 and name C4') (resid 1 and name C3')
 (resid 1 and name O3') (resid 2 and name P) 1.0 -152.0 30.0 2
assign (resid 1 and name C3') (resid 1 and name O3')
 (resid 2 and name P) (resid 2 and name O5') 1.0 -74.0 30.0 2

assign (resid 1 and name O3') (resid 2 and name P)
 (resid 2 and name O5') (resid 2 and name C5') 1.0 -62.0 30.0 2
assign (resid 2 and name P) (resid 2 and name O5')
 (resid 2 and name C5') (resid 2 and name C4') 1.0 -180.0 30.0 2
assign (resid 2 and name O5') (resid 2 and name C4')
 (resid 2 and name C4') (resid 2 and name C3') 1.0 47.0 30.0 2
assign (resid 2 and name C4') (resid 2 and name C3')
 (resid 2 and name O3') (resid 3 and name P) 1.0 -152.0 30.0 2
assign (resid 2 and name C3') (resid 2 and name O3')
 (resid 3 and name P) (resid 3 and name O5') 1.0 -74.0 30.0 2

assign (resid 2 and name O3') (resid 3 and name P)
 (resid 3 and name O5') (resid 3 and name C5') 1.0 -62.0 30.0 2
assign (resid 3 and name P) (resid 3 and name O5')
 (resid 3 and name C5') (resid 3 and name C4') 1.0 -180.0 30.0 2
assign (resid 3 and name O5') (resid 3 and name C4')
 (resid 3 and name C4') (resid 3 and name C3') 1.0 47.0 30.0 2
assign (resid 3 and name C4') (resid 3 and name C3')
 (resid 3 and name O3') (resid 4 and name P) 1.0 -152.0 30.0 2
assign (resid 3 and name C3') (resid 3 and name O3')
 (resid 4 and name P) (resid 4 and name O5') 1.0 -74.0 30.0 2

assign (resid 3 and name O3') (resid 4 and name P)
 (resid 4 and name O5') (resid 4 and name C5') 1.0 -62.0 30.0 2
assign (resid 4 and name P) (resid 4 and name O5')
 (resid 4 and name C5') (resid 4 and name C4') 1.0 -180.0 30.0 2
assign (resid 4 and name O5') (resid 4 and name C4')
 (resid 4 and name C4') (resid 4 and name C3') 1.0 47.0 30.0 2
assign (resid 4 and name C4') (resid 4 and name C3')
 (resid 4 and name O3') (resid 5 and name P) 1.0 -152.0 30.0 2
assign (resid 4 and name C3') (resid 4 and name O3')
 (resid 5 and name P) (resid 5 and name O5') 1.0 -74.0 30.0 2

assign (resid 4 and name O3') (resid 5 and name P)
 (resid 5 and name O5') (resid 5 and name C5') 1.0 -62.0 30.0 2
assign (resid 5 and name P) (resid 5 and name O5')
 (resid 5 and name C5') (resid 5 and name C4') 1.0 -180.0 30.0 2
assign (resid 5 and name O5') (resid 5 and name C4')
 (resid 5 and name C4') (resid 5 and name C3') 1.0 47.0 30.0 2
assign (resid 5 and name C4') (resid 5 and name C3')
 (resid 5 and name O3') (resid 6 and name P) 1.0 -152.0 30.0 2
assign (resid 5 and name C3') (resid 5 and name O3')
 (resid 6 and name P) (resid 6 and name O5') 1.0 -74.0 30.0 2

assign (resid 5 and name O3') (resid 6 and name P)
 (resid 6 and name O5') (resid 6 and name C5') 1.0 -62.0 30.0 2
assign (resid 6 and name P) (resid 6 and name O5')
 (resid 6 and name C5') (resid 6 and name C4') 1.0 -180.0 30.0 2
assign (resid 6 and name O5') (resid 6 and name C4')
 (resid 6 and name C4') (resid 6 and name C3') 1.0 47.0 30.0 2
assign (resid 6 and name C4') (resid 6 and name C3')
 (resid 6 and name O3') (resid 7 and name P) 1.0 -152.0 30.0 2
assign (resid 6 and name C3') (resid 6 and name O3')
 (resid 7 and name P) (resid 7 and name O5') 1.0 -74.0 30.0 2

assign (resid 6 and name O3') (resid 7 and name P)
 (resid 7 and name O5') (resid 7 and name C5') 1.0 -62.0 30.0 2
assign (resid 7 and name P) (resid 7 and name O5')
 (resid 7 and name C5') (resid 7 and name C4') 1.0 -180.0 30.0 2
assign (resid 7 and name O5') (resid 7 and name C4')
 (resid 7 and name C4') (resid 7 and name C3') 1.0 47.0 30.0 2
!assign (resid 7 and name C4') (resid 7 and name C3')
 !(resid 7 and name O3') (resid 8 and name P) 1.0 -152.0 30.0 2
!assign (resid 7 and name C3') (resid 7 and name O3')
 !(resid 8 and name P) (resid 8 and name O5') 1.0 -74.0 30.0 2

!assign (resid 12 and name O3') (resid 13 and name P)
! (resid 13 and name O5') (resid 13 and name C5') 1.0 -62.0 30.0 2
assign (resid 13 and name P) (resid 13 and name O5')
 (resid 13 and name C5') (resid 13 and name C4') 1.0 -180.0 30.0 2
assign (resid 13 and name O5') (resid 13 and name C4')
 (resid 13 and name C4') (resid 13 and name C3') 1.0 47.0 30.0 2
assign (resid 13 and name C4') (resid 13 and name C3')
 (resid 13 and name O3') (resid 14 and name P) 1.0 -152.0 30.0 2
assign (resid 13 and name C3') (resid 13 and name O3')
 (resid 14 and name P) (resid 14 and name O5') 1.0 -74.0 30.0 2

assign (resid 13 and name O3') (resid 14 and name P)
 (resid 14 and name O5') (resid 14 and name C5') 1.0 -62.0 30.0 2
assign (resid 14 and name P) (resid 14 and name O5')
 (resid 14 and name C5') (resid 14 and name C4') 1.0 -180.0 30.0 2
assign (resid 14 and name O5') (resid 14 and name C4')
 (resid 14 and name C4') (resid 14 and name C3') 1.0 47.0 30.0 2
assign (resid 14 and name C4') (resid 14 and name C3')
 (resid 14 and name O3') (resid 15 and name P) 1.0 -152.0 30.0 2
assign (resid 14 and name C3') (resid 14 and name O3')
 (resid 15 and name P) (resid 15 and name O5') 1.0 -74.0 30.0 2

assign (resid 14 and name O3') (resid 15 and name P)
 (resid 15 and name O5') (resid 15 and name C5') 1.0 -62.0 30.0 2
assign (resid 15 and name P) (resid 15 and name O5')
 (resid 15 and name C5') (resid 15 and name C4') 1.0 -180.0 30.0 2
assign (resid 15 and name O5') (resid 15 and name C4')
 (resid 15 and name C4') (resid 15 and name C3') 1.0 47.0 30.0 2
assign (resid 15 and name C4') (resid 15 and name C3')
 (resid 15 and name O3') (resid 16 and name P) 1.0 -152.0 30.0 2
assign (resid 15 and name C3') (resid 15 and name O3')
 (resid 16 and name P) (resid 16 and name O5') 1.0 -74.0 30.0 2

assign (resid 15 and name O3') (resid 16 and name P)
 (resid 16 and name O5') (resid 16 and name C5') 1.0 -62.0 30.0 2
assign (resid 16 and name P) (resid 16 and name O5')
 (resid 16 and name C5') (resid 16 and name C4') 1.0 -180.0 30.0 2
assign (resid 16 and name O5') (resid 16 and name C4')
 (resid 16 and name C4') (resid 16 and name C3') 1.0 47.0 30.0 2
assign (resid 16 and name C4') (resid 16 and name C3')
 (resid 16 and name O3') (resid 17 and name P) 1.0 -152.0 30.0 2
assign (resid 16 and name C3') (resid 16 and name O3')
 (resid 17 and name P) (resid 17 and name O5') 1.0 -74.0 30.0 2

assign (resid 16 and name O3') (resid 17 and name P)
 (resid 17 and name O5') (resid 17 and name C5') 1.0 -62.0 30.0 2
assign (resid 17 and name P) (resid 17 and name O5')
 (resid 17 and name C5') (resid 17 and name C4') 1.0 -180.0 30.0 2
assign (resid 17 and name O5') (resid 17 and name C4')
 (resid 17 and name C4') (resid 17 and name C3') 1.0 47.0 30.0 2
assign (resid 17 and name C4') (resid 17 and name C3')
 (resid 17 and name O3') (resid 18 and name P) 1.0 -152.0 30.0 2
assign (resid 17 and name C3') (resid 17 and name O3')
 (resid 18 and name P) (resid 18 and name O5') 1.0 -74.0 30.0 2

assign (resid 17 and name O3') (resid 18 and name P)
 (resid 18 and name O5') (resid 18 and name C5') 1.0 -62.0 30.0 2
assign (resid 18 and name P) (resid 18 and name O5')
 (resid 18 and name C5') (resid 18 and name C4') 1.0 -180.0 30.0 2
assign (resid 18 and name O5') (resid 18 and name C4')
 (resid 18 and name C4') (resid 18 and name C3') 1.0 47.0 30.0 2
assign (resid 18 and name C4') (resid 18 and name C3')
 (resid 18 and name O3') (resid 19 and name P) 1.0 -152.0 30.0 2
assign (resid 18 and name C3') (resid 18 and name O3')
 (resid 19 and name P) (resid 19 and name O5') 1.0 -74.0 30.0 2

assign (resid 18 and name O3') (resid 19 and name P)
 (resid 19 and name O5') (resid 19 and name C5') 1.0 -62.0 30.0 2
assign (resid 19 and name P) (resid 19 and name O5')
 (resid 19 and name C5') (resid 19 and name C4') 1.0 -180.0 30.0 2
assign (resid 19 and name O5') (resid 19 and name C4')
 (resid 19 and name C4') (resid 19 and name C3') 1.0 47.0 30.0 2
!assign (resid 19 and name C4') (resid 19 and name C3')
! (resid 19 and name O3') (resid 20 and name P) 1.0 -152.0 30.0 2
!assign (resid 19 and name C3') (resid 19 and name O3')
! (resid 20 and name P) (resid 20 and name O5') 1.0 -74.0 30.0 2



Please acknowledge these references in publications where the data from this site have been utilized.

Contact the webmaster for help, if required. Saturday, July 6, 2024 11:00:22 PM GMT (wattos1)