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
 ILE-17   ASN-18  3.3 3.2 6.3 -9.7 55.7 59.8 -0.9
 ASN-18   VAL-19  3.4 3.4 12.2 -10.0 29.5 34.1 27.1
 VAL-19   VAL-20  2.8 2.6 -1.5 3.9 110.6 111.1 -14.4
 VAL-20   ASP-21  4.8 4.9 -0.5 19.3 154.7 154.0 130.5

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
 CYS-32   LEU-33  8.4 8.2 -6.9 -8.0 36.9 43.8 49.3
 LEU-33   SER-34  7.5 7.5 -3.7 4.5 113.0 112.4 6.4
 SER-34   GLN-35  7.7 7.5 5.2 13.8 25.7 26.7 135.3

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
 CYS-99   ILE-100  1.4 1.5 -11.5 7.6 139.5 139.5 -18.8
 ILE-100   VAL-101  2.7 2.8 -0.4 4.9 140.2 139.2 15.5
 VAL-101   ASN-102  2.1 2.3 12.9 -5.9 38.5 40.1 52.4
 ASN-102   ASN-103  4.0 4.2 5.8 -2.2 33.3 34.5 7.3
 ASN-103   SER-104  1.9 2.0 -4.6 10.8 140.9 142.5 30.7

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
 ILE-111   LEU-112  4.9 5.1 -2.8 -15.1 131.4 128.1 -36.6
 LEU-112   TYR-113  5.2 4.9 -13.0 -54.3 150.4 164.0 -410.0
 TYR-113   ASP-114  3.4 3.4 -57.0 -16.3 131.2 116.7 -296.7
 ASP-114   THR-115  5.1 6.3 115.1 86.9 51.1 22.9 1305.0
 THR-115   ASN-116  5.5 4.3 -160.2 -171.1 66.1 157.1 89.0
 ASN-116   LEU-117  7.6 6.6 -109.6 -19.4 145.9 111.6 -508.3
 LEU-117   PRO-118  9.3 8.9 -21.5 -7.5 104.5 103.9 -24.2
 PRO-118   ASP-119  12.2 12.1 7.3 -2.6 130.8 137.8 -14.2
 ASP-119   VAL-120  15.2 14.9 0.0 -8.6 116.0 107.9 4.9

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