Ketohexokinase

(All numbering and residues are taken from first PDB file)

Bending Residue Dihedral Analysis

Residue
i
Residue
i+1
Distance of hinge axis to residue i in conformer 1
(A)
Distance of hinge axis to residue i in conformer 2
(A)
Change in psi (i)
(deg)
Change in phi (i+1)
(deg)
Angle of psi(i) axis to hinge axis conformer 1
(deg)
Angle of psi(i) axis to hinge axis conformer 2
(deg)
Percentage Progress
 VAL-12   VAL-13  7.0 6.9 -5.0 -4.4 87.4 83.8 9.6
 VAL-13   LEU-14  3.4 3.7 7.6 -5.4 169.6 168.2 -12.7
 LEU-14   ASP-15  2.1 3.1 -1.2 -6.6 85.7 89.0 -6.6
 ASP-15   VAL-16  1.9 0.9 3.7 4.1 147.4 150.1 -19.3
 VAL-16   ILE-17  3.1 3.7 17.2 -15.9 101.9 95.6 30.8

Downloading Image

Graph shows rotational transition at bending residues and can be used to identify hinge bending residues.
Probably only informative for interdomain rotations greater than 20 degrees


Residue
i
Residue
i+1
Distance of hinge axis to residue i in conformer 1
(A)
Distance of hinge axis to residue i in conformer 2
(A)
Change in psi (i)
(deg)
Change in phi (i+1)
(deg)
Angle of psi(i) axis to hinge axis conformer 1
(deg)
Angle of psi(i) axis to hinge axis conformer 2
(deg)
Percentage Progress
 SER-34   GLN-35  8.1 8.2 -13.2 10.6 24.5 24.9 9.6
 GLN-35   ARG-36  5.8 6.0 5.0 9.0 87.7 88.2 -16.1
 ARG-36   TRP-37  2.4 2.5 -17.3 -8.9 24.3 34.5 81.2
 TRP-37   GLN-38  0.5 1.5 -14.8 12.8 84.0 82.7 -10.4
 GLN-38   ARG-39  3.7 2.5 20.1 -20.0 153.2 148.4 -13.8

Downloading Image

Graph shows rotational transition at bending residues and can be used to identify hinge bending residues.
Probably only informative for interdomain rotations greater than 20 degrees


Residue
i
Residue
i+1
Distance of hinge axis to residue i in conformer 1
(A)
Distance of hinge axis to residue i in conformer 2
(A)
Change in psi (i)
(deg)
Change in phi (i+1)
(deg)
Angle of psi(i) axis to hinge axis conformer 1
(deg)
Angle of psi(i) axis to hinge axis conformer 2
(deg)
Percentage Progress
 THR-90   THR-91  17.0 18.1 -7.1 8.9 98.3 105.0 9.6
 THR-91   GLY-92  14.5 15.6 -22.8 20.2 66.9 68.9 16.1
 GLY-92   SER-93  11.2 12.6 -1.8 39.2 17.4 9.6 -118.8
 SER-93   VAL-94  9.5 10.8 -17.4 -5.8 84.2 76.4 39.0
 VAL-94   PRO-95  6.7 9.0 -6.9 12.8 89.2 81.0 3.8
 PRO-95   ILE-96  3.5 5.2 -26.0 -14.7 26.7 21.0 135.2
 ILE-96   ALA-97  2.9 4.4 21.2 -24.6 83.0 76.7 -6.4
 ALA-97   THR-98  3.5 4.0 30.6 -22.6 149.2 146.5 -26.2

Downloading Image

Graph shows rotational transition at bending residues and can be used to identify hinge bending residues.
Probably only informative for interdomain rotations greater than 20 degrees


Residue
i
Residue
i+1
Distance of hinge axis to residue i in conformer 1
(A)
Distance of hinge axis to residue i in conformer 2
(A)
Change in psi (i)
(deg)
Change in phi (i+1)
(deg)
Angle of psi(i) axis to hinge axis conformer 1
(deg)
Angle of psi(i) axis to hinge axis conformer 2
(deg)
Percentage Progress
 TYR-112   TYR-113  5.6 5.5 31.4 56.2 112.9 98.4 -65.7
 TYR-113   ASP-114  5.8 4.4 49.4 2.9 112.9 157.2 -162.1
 ASP-114   ARG-115  4.5 6.6 39.7 22.6 89.3 125.8 590.8
 ARG-115   SER-116  7.3 5.9 -33.2 -120.7 49.7 81.4 -283.6

Downloading Image

Graph shows rotational transition at bending residues and can be used to identify hinge bending residues.
Probably only informative for interdomain rotations greater than 20 degrees