NMR Restraints Grid

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

image mrblock_id pdb_id cing stage position program type subtype subsubtype
275440 2kjb cing 1-original 2 XPLOR/CNS distance hydrogen bond simple


!H-Bond
!Protomer-1

   !! helix I  res 9 - 23

assign ( segid a and resid  13 and name o ) ( segid a and resid  17 and name n ) 3.0  0.5  0.5
assign ( segid a and resid  13 and name o ) ( segid a and resid  17 and name hn) 2.1  0.6  0.5

assign ( segid a and resid  14 and name o ) ( segid a and resid  18 and name n ) 3.0  0.5  0.5
assign ( segid a and resid  14 and name o ) ( segid a and resid  18 and name hn) 2.1  0.6  0.5

assign ( segid a and resid  15 and name o ) ( segid a and resid  19 and name n ) 3.0  0.5  0.5
assign ( segid a and resid  15 and name o ) ( segid a and resid  19 and name hn) 2.1  0.6  0.5

assign ( segid a and resid  16 and name o ) ( segid a and resid  20 and name n ) 3.0  0.5  0.5
assign ( segid a and resid  16 and name o ) ( segid a and resid  20 and name hn) 2.1  0.6  0.5

assign ( segid a and resid  17 and name o ) ( segid a and resid  21 and name n ) 3.0  0.5  0.5
assign ( segid a and resid  17 and name o ) ( segid a and resid  21 and name hn) 2.1  0.6  0.5

assign ( segid a and resid  18 and name o ) ( segid a and resid  22 and name n ) 3.0  0.5  0.8
assign ( segid a and resid  18 and name o ) ( segid a and resid  22 and name hn) 2.1  0.6  0.8

assign ( segid a and resid  19 and name o ) ( segid a and resid  23 and name n ) 3.0  0.5  1.2
assign ( segid a and resid  19 and name o ) ( segid a and resid  23 and name hn) 2.1  0.6  1.2

!!Helix II  25-38 

!assign ( segid a and resid  25 and name o ) ( segid a and resid  29 and name n ) 3.0  0.5  0.8
!assign ( segid a and resid  25 and name o ) ( segid a and resid  29 and name hn) 2.1  0.6  0.8

!assign ( segid a and resid  26 and name o ) ( segid a and resid  30 and name n ) 3.0  0.5  0.8
!assign ( segid a and resid  26 and name o ) ( segid a and resid  30 and name hn) 2.1  0.6  0.8

assign ( segid a and resid  30 and name o ) ( segid a and resid  34 and name n ) 3.0  0.5  0.5
assign ( segid a and resid  30 and name o ) ( segid a and resid  34 and name hn) 2.1  0.6  0.5

assign ( segid a and resid  31 and name o ) ( segid a and resid  35 and name n ) 3.0  0.5  0.5
assign ( segid a and resid  31 and name o ) ( segid a and resid  35 and name hn) 2.1  0.6  0.5

assign ( segid a and resid  32 and name o ) ( segid a and resid  36 and name n ) 3.0  0.5  0.5
assign ( segid a and resid  32 and name o ) ( segid a and resid  36 and name hn) 2.1  0.6  0.5

!assign ( segid a and resid  33 and name o ) ( segid a and resid  37 and name n ) 3.0  0.5  1.2
!assign ( segid a and resid  33 and name o ) ( segid a and resid  37 and name hn) 2.1  0.6  1.2


!!Helix III  41-50 

assign ( segid a and resid  43 and name o ) ( segid a and resid  47 and name n ) 3.0  0.5  0.5
assign ( segid a and resid  43 and name o ) ( segid a and resid  47 and name hn) 2.1  0.6  0.5

assign ( segid a and resid  44 and name o ) ( segid a and resid  48 and name n ) 3.0  0.5  0.5
assign ( segid a and resid  44 and name o ) ( segid a and resid  48 and name hn) 2.1  0.6  0.5

!!Helix IV  52-66 

assign ( segid a and resid  52 and name o ) ( segid a and resid  56 and name n ) 3.0  0.5  1.5
assign ( segid a and resid  52 and name o ) ( segid a and resid  56 and name hn) 2.1  0.6  1.5

!assign ( segid a and resid  53 and name o ) ( segid a and resid  57 and name n ) 3.0  0.5  0.5
!assign ( segid a and resid  53 and name o ) ( segid a and resid  57 and name hn) 2.1  0.6  0.5

assign ( segid a and resid  55 and name o ) ( segid a and resid  59 and name n ) 3.0  0.5  0.5
assign ( segid a and resid  55 and name o ) ( segid a and resid  59 and name hn) 2.1  0.6  1.5

assign ( segid a and resid  56 and name o ) ( segid a and resid  60 and name n ) 3.0  0.5  1.5
assign ( segid a and resid  56 and name o ) ( segid a and resid  60 and name hn) 2.1  0.6  1.5

assign ( segid a and resid  57 and name o ) ( segid a and resid  61 and name n ) 3.0  0.5  0.5
assign ( segid a and resid  57 and name o ) ( segid a and resid  61 and name hn) 2.1  0.6  0.5

assign ( segid a and resid  59 and name o ) ( segid a and resid  63 and name n ) 3.0  0.5  0.5
assign ( segid a and resid  59 and name o ) ( segid a and resid  63 and name hn) 2.1  0.6  0.5

assign ( segid a and resid  60 and name o ) ( segid a and resid  64 and name n ) 3.0  0.5  0.5
assign ( segid a and resid  60 and name o ) ( segid a and resid  64 and name hn) 2.1  0.6  0.5

assign ( segid a and resid  61 and name o ) ( segid a and resid  65 and name n ) 3.0  0.5  0.5
assign ( segid a and resid  61 and name o ) ( segid a and resid  65 and name hn) 2.1  0.6  0.5

!!Helix V  84-100 

assign ( segid a and resid  86 and name o ) ( segid a and resid  90 and name n ) 3.0  0.5  0.5
assign ( segid a and resid  86 and name o ) ( segid a and resid  90 and name hn) 2.1  0.6  0.5

assign ( segid a and resid  87 and name o ) ( segid a and resid  91 and name n ) 3.0  0.5  0.5
assign ( segid a and resid  87 and name o ) ( segid a and resid  91 and name hn) 2.1  0.6  0.5

assign ( segid a and resid  88 and name o ) ( segid a and resid  92 and name n ) 3.0  0.5  0.5
assign ( segid a and resid  88 and name o ) ( segid a and resid  92 and name hn) 2.1  0.6  0.5

assign ( segid a and resid  89 and name o ) ( segid a and resid  93 and name n ) 3.0  0.5  0.5
assign ( segid a and resid  89 and name o ) ( segid a and resid  93 and name hn) 2.1  0.6  0.5

assign ( segid a and resid  90 and name o ) ( segid a and resid  94 and name n ) 3.0  0.5  0.5
assign ( segid a and resid  90 and name o ) ( segid a and resid  94 and name hn) 2.1  0.6  0.5

assign ( segid a and resid  91 and name o ) ( segid a and resid  95 and name n ) 3.0  0.5  0.5
assign ( segid a and resid  91 and name o ) ( segid a and resid  95 and name hn) 2.1  0.6  0.5

assign ( segid a and resid  92 and name o ) ( segid a and resid  96 and name n ) 3.0  0.5  0.5
assign ( segid a and resid  92 and name o ) ( segid a and resid  96 and name hn) 2.1  0.6  0.5

assign ( segid a and resid  93 and name o ) ( segid a and resid  97 and name n ) 3.0  0.5  0.5
assign ( segid a and resid  93 and name o ) ( segid a and resid  97 and name hn) 2.1  0.6  0.5

!!beta sheet region:
assign ( segid a and resid  81 and name o ) ( segid a and resid  70 and name n ) 3.0  0.7  0.5
assign ( segid a and resid  81 and name o ) ( segid a and resid  70 and name hn) 2.0  0.7  0.5

assign ( segid a and resid  70 and name o ) ( segid a and resid  81 and name n ) 3.0  0.7  0.8
assign ( segid a and resid  70 and name o ) ( segid a and resid  81 and name hn) 2.0  0.7  0.8

assign ( segid a and resid  79 and name o ) ( segid a and resid  72 and name n ) 3.0  0.7  0.8
assign ( segid a and resid  79 and name o ) ( segid a and resid  72 and name hn) 2.0  0.7  0.8

assign ( segid a and resid  72 and name o ) ( segid a and resid  79 and name n ) 3.0  0.7  0.5
assign ( segid a and resid  72 and name o ) ( segid a and resid  79 and name hn) 2.0  0.7  0.5


!Protomer-2
   !! helix I  res 9 - 23

assign ( segid b and resid  13 and name o ) ( segid b and resid  17 and name n ) 3.0  0.5  0.5
assign ( segid b and resid  13 and name o ) ( segid b and resid  17 and name hn) 2.1  0.6  0.5

assign ( segid b and resid  14 and name o ) ( segid b and resid  18 and name n ) 3.0  0.5  0.5
assign ( segid b and resid  14 and name o ) ( segid b and resid  18 and name hn) 2.1  0.6  0.5

assign ( segid b and resid  15 and name o ) ( segid b and resid  19 and name n ) 3.0  0.5  0.5
assign ( segid b and resid  15 and name o ) ( segid b and resid  19 and name hn) 2.1  0.6  0.5

assign ( segid b and resid  16 and name o ) ( segid b and resid  20 and name n ) 3.0  0.5  0.5
assign ( segid b and resid  16 and name o ) ( segid b and resid  20 and name hn) 2.1  0.6  0.5

assign ( segid b and resid  17 and name o ) ( segid b and resid  21 and name n ) 3.0  0.5  0.5
assign ( segid b and resid  17 and name o ) ( segid b and resid  21 and name hn) 2.1  0.6  0.5

assign ( segid b and resid  18 and name o ) ( segid b and resid  22 and name n ) 3.0  0.5  0.8
assign ( segid b and resid  18 and name o ) ( segid b and resid  22 and name hn) 2.1  0.6  0.8

assign ( segid b and resid  19 and name o ) ( segid b and resid  23 and name n ) 3.0  0.5  1.2
assign ( segid b and resid  19 and name o ) ( segid b and resid  23 and name hn) 2.1  0.6  1.2

!!Helix II  25-38

!assign ( segid b and resid  25 and name o ) ( segid b and resid  29 and name n ) 3.0  0.5  0.8
!assign ( segid b and resid  25 and name o ) ( segid b and resid  29 and name hn) 2.1  0.6  0.8

!assign ( segid b and resid  26 and name o ) ( segid b and resid  30 and name n ) 3.0  0.5  0.8
!assign ( segid b and resid  26 and name o ) ( segid b and resid  30 and name hn) 2.1  0.6  0.8

assign ( segid b and resid  30 and name o ) ( segid b and resid  34 and name n ) 3.0  0.5  0.5
assign ( segid b and resid  30 and name o ) ( segid b and resid  34 and name hn) 2.1  0.6  0.5

assign ( segid b and resid  31 and name o ) ( segid b and resid  35 and name n ) 3.0  0.5  0.5
assign ( segid b and resid  31 and name o ) ( segid b and resid  35 and name hn) 2.1  0.6  0.5

assign ( segid b and resid  32 and name o ) ( segid b and resid  36 and name n ) 3.0  0.5  0.5
assign ( segid b and resid  32 and name o ) ( segid b and resid  36 and name hn) 2.1  0.6  0.5

!assign ( segid b and resid  33 and name o ) ( segid b and resid  37 and name n ) 3.0  0.5  1.2
!assign ( segid b and resid  33 and name o ) ( segid b and resid  37 and name hn) 2.1  0.6  1.2


!!Helix III  41-50

assign ( segid b and resid  43 and name o ) ( segid b and resid  47 and name n ) 3.0  0.5  0.5
assign ( segid b and resid  43 and name o ) ( segid b and resid  47 and name hn) 2.1  0.6  0.5

assign ( segid b and resid  44 and name o ) ( segid b and resid  48 and name n ) 3.0  0.5  0.5
assign ( segid b and resid  44 and name o ) ( segid b and resid  48 and name hn) 2.1  0.6  0.5

!!Helix IV  52-66

assign ( segid b and resid  52 and name o ) ( segid b and resid  56 and name n ) 3.0  0.5  1.5
assign ( segid b and resid  52 and name o ) ( segid b and resid  56 and name hn) 2.1  0.6  1.5

!assign ( segid b and resid  53 and name o ) ( segid b and resid  57 and name n ) 3.0  0.5  0.5
!assign ( segid b and resid  53 and name o ) ( segid b and resid  57 and name hn) 2.1  0.6  0.5

assign ( segid b and resid  55 and name o ) ( segid b and resid  59 and name n ) 3.0  0.5  0.5
assign ( segid b and resid  55 and name o ) ( segid b and resid  59 and name hn) 2.1  0.6  1.5

assign ( segid b and resid  56 and name o ) ( segid b and resid  60 and name n ) 3.0  0.5  1.5
assign ( segid b and resid  56 and name o ) ( segid b and resid  60 and name hn) 2.1  0.6  1.5

assign ( segid b and resid  57 and name o ) ( segid b and resid  61 and name n ) 3.0  0.5  0.5
assign ( segid b and resid  57 and name o ) ( segid b and resid  61 and name hn) 2.1  0.6  0.5
assign ( segid b and resid  59 and name o ) ( segid b and resid  63 and name n ) 3.0  0.5  0.5
assign ( segid b and resid  59 and name o ) ( segid b and resid  63 and name hn) 2.1  0.6  0.5

assign ( segid b and resid  60 and name o ) ( segid b and resid  64 and name n ) 3.0  0.5  0.5
assign ( segid b and resid  60 and name o ) ( segid b and resid  64 and name hn) 2.1  0.6  0.5

assign ( segid b and resid  61 and name o ) ( segid b and resid  65 and name n ) 3.0  0.5  0.5
assign ( segid b and resid  61 and name o ) ( segid b and resid  65 and name hn) 2.1  0.6  0.5

!!Helix V  84-100

assign ( segid b and resid  86 and name o ) ( segid b and resid  90 and name n ) 3.0  0.5  0.5
assign ( segid b and resid  86 and name o ) ( segid b and resid  90 and name hn) 2.1  0.6  0.5

assign ( segid b and resid  87 and name o ) ( segid b and resid  91 and name n ) 3.0  0.5  0.5
assign ( segid b and resid  87 and name o ) ( segid b and resid  91 and name hn) 2.1  0.6  0.5

assign ( segid b and resid  88 and name o ) ( segid b and resid  92 and name n ) 3.0  0.5  0.5
assign ( segid b and resid  88 and name o ) ( segid b and resid  92 and name hn) 2.1  0.6  0.5

assign ( segid b and resid  89 and name o ) ( segid b and resid  93 and name n ) 3.0  0.5  0.5
assign ( segid b and resid  89 and name o ) ( segid b and resid  93 and name hn) 2.1  0.6  0.5

assign ( segid b and resid  90 and name o ) ( segid b and resid  94 and name n ) 3.0  0.5  0.5
assign ( segid b and resid  90 and name o ) ( segid b and resid  94 and name hn) 2.1  0.6  0.5

assign ( segid b and resid  91 and name o ) ( segid b and resid  95 and name n ) 3.0  0.5  0.5
assign ( segid b and resid  91 and name o ) ( segid b and resid  95 and name hn) 2.1  0.6  0.5

assign ( segid b and resid  92 and name o ) ( segid b and resid  96 and name n ) 3.0  0.5  0.5
assign ( segid b and resid  92 and name o ) ( segid b and resid  96 and name hn) 2.1  0.6  0.5

assign ( segid b and resid  93 and name o ) ( segid b and resid  97 and name n ) 3.0  0.5  0.5
assign ( segid b and resid  93 and name o ) ( segid b and resid  97 and name hn) 2.1  0.6  0.5

!!beta sheet region:
assign ( segid b and resid  81 and name o ) ( segid b and resid  70 and name n ) 3.0  0.7  0.5
assign ( segid b and resid  81 and name o ) ( segid b and resid  70 and name hn) 2.0  0.7  0.5

assign ( segid b and resid  70 and name o ) ( segid b and resid  81 and name n ) 3.0  0.7  0.5
assign ( segid b and resid  70 and name o ) ( segid b and resid  81 and name hn) 2.0  0.7  0.5

assign ( segid b and resid  79 and name o ) ( segid b and resid  72 and name n ) 3.0  0.7  0.5
assign ( segid b and resid  79 and name o ) ( segid b and resid  72 and name hn) 2.0  0.7  0.5

assign ( segid b and resid  72 and name o ) ( segid b and resid  79 and name n ) 3.0  0.7  0.5
assign ( segid b and resid  72 and name o ) ( segid b and resid  79 and name hn) 2.0  0.7  0.5




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

Contact the webmaster for help, if required. Thursday, July 4, 2024 12:56:16 AM GMT (wattos1)