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
7748 1kyj 5301 cing 1-original 1 XPLOR/CNS distance NOE ambi


! noe scale NOE 75.0 end

!W 3.40 1.60 1.60 ! W 5.0
!M 2.90 1.10 1.10 ! M 4.0
!S 2.40 0.60 0.60 ! S 3.0

! THR 3 

assi (resi  3 and resn THR  and name HN  )
     (resi  2 and resn THR  and name HN  ) 3.40 1.60 1.60 ! W
assi (resi  3 and resn THR  and name HN  )
     (resi  4 and resn ALA  and name HN  ) 3.40 1.60 1.60 ! W
assi (resi  3 and resn THR  and name HN  )
     (resi 13 and resn T3G1 and name HN2 ) 2.90 1.10 1.10 ! M
assi (resi  3 and resn THR  and name HN  )
     (resi  2 and resn THR  and name HA  ) 2.40 0.60 0.60 ! S
assi (resi  3 and resn THR  and name HN  )
     (resi  2 and resn THR  and name HB  ) 2.40 0.60 0.60 ! S
assi (resi  3 and resn THR  and name HN  )
     (resi 10 and resn T2G1 and name H1  ) 2.90 1.10 1.10 ! M
assi (resi  3 and resn THR  and name HN  )
     (resi  3 and resn THR  and name HB  ) 2.90 1.10 1.10 ! M
assi (resi  3 and resn THR  and name HN  )
     (resi  3 and resn THR  and name HA  ) 2.90 1.10 1.10 ! M
assi (resi  3 and resn THR  and name HN  )
     (resi  2 and resn THR  and name HG2*) 2.90 1.10 1.10 ! M
assi (resi  3 and resn THR  and name HN  )
     (resi  3 and resn THR  and name HG2*) 2.90 1.10 1.10 ! M
assi (resi  3 and resn THR  and name HN  )
     (resi 13 and resn T3G1 and name H2  ) 3.40 1.60 1.60 ! W
assi (resi  3 and resn THR  and name HN  )
     (resi 13 and resn T3G1 and name H8* ) 3.40 1.60 1.60 ! W
assi (resi  3 and resn THR  and name HN  )
     ((resi 10 or resi 13)  and name H3  ) 3.40 1.60 1.60 ! W
assi (resi  3 and resn THR  and name HN  )
     (resi  4 and resn ALA  and name HA  ) 3.40 1.60 1.60 ! W
assi (resi  3 and resn THR  and name HN  )
     (resi 13 and resn T3G1 and name H4  ) 3.40 1.60 1.60 ! W

     
assi (resi  3 and resn THR  and name HA  )
     (resi  3 and resn THR  and name HB  ) 2.90 1.10 1.10 ! M
assi (resi  3 and resn THR  and name HA  )
     (resi  3 and resn THR  and name HG2*) 2.40 0.60 0.60 ! S     
assi (resi  3 and resn THR  and name HG2*)
     (resi 13 and resn T3G1 and name H1  ) 3.40 1.60 1.60 ! W
assi (resi  3 and resn THR  and name HG2*)
     (resi 13 and resn T3G1 and name H3  ) 3.40 1.60 1.60 ! W
assi (resi  3 and resn THR  and name HG2*)
     (resi 13 and resn T3G1 and name H4  ) 3.40 1.60 1.60 ! W
assi (resi  3 and resn THR  and name HG2*)
     (resi  7 and resn S1G1 and name H8* ) 2.90 1.10 1.10 ! M
assi (resi  3 and resn THR  and name HA  )
     (resi  7 and resn S1G1 and name H8* ) 3.40 1.60 1.60 ! W
assi (resi  3 and resn THR and name  HB  )
     (resi  7 and resn S1G1 and name H8* ) 3.40 1.60 1.60 ! W

     
! THR 2 

assi (resi  2 and resn THR  and name HN  )
     (resi  1 and resn SER  and name HN  ) 3.40 1.60 1.60 ! W
assi (resi  2 and resn THR  and name HN  )
     (resi 10 and resn T2G1 and name HN2 ) 2.90 1.10 1.10 ! M
assi (resi  2 and resn THR  and name HN  )
     (resi  1 and resn SER  and name HB1 ) 2.90 1.10 1.10 ! M
assi (resi  2 and resn THR  and name HN  )
     (resi  1 and resn SER  and name HB2 ) 2.90 1.10 1.10 ! M
assi (resi  2 and resn THR  and name HN  )
     (resi  2 and resn THR  and name HB  ) 3.40 1.60 1.60 ! W
assi (resi  2 and resn THR  and name HN  )
     (resi  2 and resn THR  and name HG2*) 2.90 1.10 1.10 ! M
assi (resi  2 and resn THR  and name HN  )
     ((resi 10 or resi 13) and name H3   ) 3.40 1.60 1.60 ! W
assi (resi  2 and resn THR  and name HN  )
     (resi  2 and resn THR  and name HA  ) 2.90 1.10 1.10 ! M
assi (resi  2 and resn THR  and name HN  )
     (resi  1 and resn SER  and name HA  ) 2.40 0.60 0.60 ! S
assi (resi 2 and resn THR and name HN    )
     ((resi 7 or resi 10) and name H1    ) 3.40 1.60 1.60 ! W
assi (resi  2 and resn THR  and name HN  )
     (resi 10 and resn T2G1 and name H4  ) 3.40 1.60 1.60 ! W

assi (resi  2 and resn THR  and name HG2*)
     (resi 10 and resn T2G1 and name H4  ) 3.40 1.60 1.60 ! W
assi (resi  2 and resn THR  and name HG2*)
     (resi 10 and resn T2G1 and name H3  ) 3.40 1.60 1.60 ! W 
assi (resi  2 and resn THR  and name HA  )
     (resi  2 and resn THR  and name HB  ) 2.90 1.10 1.10 ! M
assi (resi  2 and resn THR  and name HB  )
     (resi 10 and resn T2G1 and name H1  ) 2.90 1.10 1.10 ! M
assi (resi  2 and resn THR  and name HG2*)
     (resi  2 and resn THR  and name HA  ) 2.90 1.10 1.10 ! M
assi (resi  2 and resn THR  and name HB  )
     (resi  3 and resn THR  and name HG2* ) 3.40 1.60 1.60 ! W

     
! SER 1 

assi (resi  1 and resn SER  and name HN  )
     (resi  1 and resn SER  and name HB1 ) 2.90 1.10 1.10 ! M
assi (resi  1 and resn SER  and name HN  )
     (resi  1 and resn SER  and name HB2 ) 2.90 1.10 1.10 ! M
assi (resi  1 and resn SER  and name HN  )
     (resi  7 and resn S1G1 and name HN2 ) 3.40 1.60 1.60 ! W
assi (resi  1 and resn SER  and name HN  )
     (resi  1 and resn SER  and name H2* ) 2.90 1.10 1.10 ! M
assi (resi  1 and resn SER  and name HN  )
     (resi  1 and resn SER  and name HA  ) 2.90 1.10 1.10 ! M
assi (resi  1 and resn SER  and name HN  )
     (resi  7 and resn S1G1 and name H3  ) 2.90 1.10 1.10 ! M
assi (resi  1 and resn SER  and name HN  )
     (resi  7 and resn S1G1 and name H1  ) 3.40 1.60 1.60 ! W
     
assi (resi  1 and resn SER  and name HA  )
     (resi  1 and resn SER  and name HB2 ) 2.90 1.10 1.10 ! M
assi (resi  1 and resn SER  and name HA  )
     (resi  1 and resn SER  and name HB1 ) 2.90 1.10 1.10 ! M
assi (resi  7 and resn S1G1 and name H1  )
     (resi  1 and resn SER  and name HB2 ) 2.90 1.10 1.10 ! M
assi (resi  7 and resn S1G1 and name H1  )
     (resi  1 and resn SER  and name HB1 ) 2.90 1.10 1.10 ! M


! ALA 4 

assi (resi  4 and resn ALA  and name HN  )
     (resi  5 and resn VAL  and name HN  ) 2.90 1.10 1.10 ! M
assi (resi  4 and resn ALA  and name HN  )
     (resi 10 and resn T2G1 and name H1  ) 3.65 1.85 1.85 ! W 
assi (resi  4 and resn ALA  and name HN  )
     (resi  3 and resn THR  and name HA  ) 2.40 0.60 0.60 ! S
assi (resi  4 and resn ALA  and name HN  )
     (resi  4 and resn ALA  and name HA  ) 2.90 1.10 1.10 ! M
assi (resi  4 and resn ALA  and name HN  )
     (resi  3 and resn THR  and name HB  ) 2.40 0.60 0.60 ! S
assi (resi  4 and resn ALA  and name HN  )
     (resi  4 and resn ALA  and name HB* ) 2.90 1.10 1.10 ! M
assi (resi  4 and resn ALA  and name HN  )
     (resi  3 and resn THR  and name HG2*) 3.40 1.60 1.60 ! W
assi (resi  4 and resn ALA  and name HN  )
     (resi 10 and resn T2G1 and name H8* ) 2.90 1.10 1.10 ! M
assi (resi  4 and resn ALA  and name HN  )
     (resi 13 and resn T3G1 and name H1  ) 3.40 1.60 1.60 ! W 

assi (resi  4 and resn ALA  and name HB* )
     (resi  3 and resn THR  and name HA  ) 3.40 1.60 1.60 ! W
assi (resi  4 and resn ALA  and name HB* )
     (resi 10 and resn T2G1 and name H8* ) 2.90 1.10 1.10 ! M
assi (resi  4 and resn ALA  and name HA  )
     (resi 13 and resn T3G1 and name H8* ) 3.40 1.60 1.60 ! W


! VAL 5 

assi (resi  5 and resn VAL  and name HN  )
     (resi  4 and resn ALA  and name HA  ) 2.40 0.60 0.60 ! S
assi (resi  5 and resn VAL  and name HN  )
     (resi  5 and resn VAL  and name HB  ) 2.90 1.10 1.10 ! M
assi (resi  5 and resn VAL  and name HN  )
     (resi  5 and resn VAL  and name HA  ) 2.90 1.10 1.10 ! M
assi (resi  5 and resn VAL  and name HN  )
     (resi  4 and resn ALA  and name HB* ) 2.90 1.10 1.10 ! M
assi (resi  5 and resn VAL  and name HN  )
     (resi  5 and resn VAL  and name HG* ) 3.40 1.60 1.60 ! W

     
assi (resi  5 and resn VAL  and name HG* )
     (resi  4 and resn ALA  and name HA  ) 3.40 1.60 1.60 ! W
assi (resi  5 and resn VAL  and name HG* )
     (resi  5 and resn VAL  and name HA  ) 3.40 1.60 1.60 ! W

! SER1 GalNAC 

assi (resi  7 and resn S1G1 and name HN2 )
     (resi  7 and resn S1G1 and name H1  ) 2.90 1.10 1.10 ! M
assi (resi  7 and resn S1G1 and name HN2 )
     (resi  7 and resn S1G1 and name H2  ) 2.90 1.10 1.10 ! M
assi (resi  7 and resn S1G1 and name HN2 )
     (resi  7 and resn S1G1 and name H3  ) 2.90 1.10 1.10 ! M
assi (resi  7 and resn S1G1 and name HN2 )
     (resi  7 and resn S1G1 and name H8* ) 2.90 1.10 1.10 ! M
assi (resi  7 and resn S1G1 and name HN2 )
     (resi  1 and resn SER  and name HB* ) 3.40 1.60 1.60 ! W
assi (resi  7 and resn S1G1 and name HN2 )
     (resi  1 and resn SER  and name HA  ) 3.40 1.60 1.60 ! W
assi (resi  7 and resn S1G1 and name HN2 )
     (resi  8 and resn S1G3 and name H1  ) 2.90 1.10 1.10 ! M
     
assi (resi  7 and resn S1G1 and name H3  )
     (resi  8 and resn S1G3 and name H1  ) 2.40 0.60 0.60 ! S
assi (resi  7 and resn S1G1 and name H1 )
     (resi  7 and resn S1G1 and name H2  ) 2.90 1.10 1.10 ! M
assi (resi  7 and resn S1G1 and name H2  )
     (resi  8 and resn S1G3 and name H1  ) 3.40 1.60 1.60 ! w 

     
! THR3 GalNAC 

assi (resi 13 and resn T3G1 and name HN2 )
     (resi 13 and resn T3G1 and name H1  ) 2.90 1.10 1.10 ! M
assi (resi 13 and resn T3G1 and name HN2 )
     (resi 10 and resn T2G1 and name H1  ) 3.40 1.60 1.60 ! W 
assi (resi 13 and resn T3G1 and name HN2 )
     (resi 13 and resn T3G1 and name H3  ) 2.90 1.10 1.10 ! M
assi (resi 13 and resn T3G1 and name HN2 )
     (resi 13 and resn T3G1 and name H2  ) 2.90 1.10 1.10 ! M
assi (resi 13 and resn T3G1 and name HN2 )
     (resi 13 and resn T3G1 and name H8* ) 2.90 1.10 1.10 ! M
assi (resi 13 and resn T3G1 and name HN2 )
     (resi  2 and resn THR  and name HG2*) 3.40 1.60 1.60 ! W
assi (resi 13 and resn T3G1 and name HN2 )
     (resi  3 and resn THR  and name HB  ) 3.40 1.60 1.60 ! W
assi (resi 13 and resn T3G1 and name HN2 )
     (resi  3 and resn THR  and name HG2*) 3.40 1.60 1.60 ! W
assi (resi 13 and resn T3G1 and name HN2 )
     (resi  2 and resn THR  and name HB  ) 3.40 1.60 1.60 ! W
assi (resi 13 and resn T3G1 and name HN2 )
     (resi  3 and resn THR  and name HA  ) 3.40 1.60 1.60 ! W
assi (resi 13 and resn T3G1 and name HN2 )
     (resi 14 and resn T3G3 and name H1  ) 2.90 1.10 1.10 ! M


assi (resi 13 and resn T3G1 and name H3  )
     (resi 14 and resn T3G3 and name H1  ) 2.40 0.60 0.60 ! S
assi (resi 13 and resn T3G1 and name H2  )
     (resi 14 and resn T3G3 and name H1  ) 3.40 1.60 1.60 ! W     
assi (resi 13 and resn T3G1 and name H1  )
     (resi  3 and resn THR  and name HB  ) 3.40 1.60 1.60 ! W
assi (resi 13 and resn T3G1 and name H2 )
     (resi 13 and resn T3G1 and name H1  ) 2.90 1.10 1.10 ! M


! THR2 GalNAC 

assi (resi 10 and resn T2G1 and name HN2 )
     (resi 10 and resn T2G1 and name H1  ) 2.90 1.10 1.10 ! M
assi (resi 10 and resn T2G1 and name HN2 )
     (resi  3 and resn THR  and name HA  ) 3.40 1.60 1.60 ! W
assi (resi 10 and resn T2G1 and name HN2 )
     (resi 10 and resn T2G1 and name H2  ) 2.90 1.10 1.10 ! M
assi (resi 10 and resn T2G1 and name HN2 )
     (resi 10 and resn T2G1 and name H8* ) 2.90 1.10 1.10 ! M
assi (resi 10 and resn T2G1 and name HN2 )
     (resi 10 and resn T2G1 and name H3  ) 2.90 1.10 1.10 ! M
assi (resi 10 and resn T2G1 and name HN2 )
     (resi  2 and resn THR  and name HG2*) 3.65 1.85 1.85 ! W 
assi (resi 10 and resn T2G1 and name HN2 )
     ((resi  2 and name HA) or (resi 13 and name H1)) 3.40 1.60 1.60 ! W
assi (resi 10 and resn T2G1 and name HN2 )
     (resi 11 and resn T2G3 and name H1  ) 2.90 1.10 1.10 ! M

assi (resi 10 and resn T2G1 and name H2  )
     (resi 11 and resn T2G3 and name H1  ) 3.40 1.60 1.60 ! W
assi (resi 10 and resn T2G1 and name H3  )
     (resi 11 and resn T2G3 and name H1  ) 2.40 0.60 0.60 ! S
assi (resi 10 and resn T2G1 and name H1  )
     (resi 10 and resn T2G1 and name H2  ) 2.90 1.10 1.10 ! M
assi (resi 10 and resn T2G1 and name H1  )
     (resi  2 and resn THR  and name HG2*) 2.90 1.10 1.10 ! M



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

Contact the webmaster for help, if required. Thursday, May 2, 2024 5:38:56 AM GMT (wattos1)