3-Isopropylmalate Dehydrogenase

(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
 ASP-98   LEU-99  2.7 2.6 -3.3 -14.4 29.2 28.6 42.6
 LEU-99   PHE-100  2.3 2.5 -33.6 25.1 77.0 64.2 11.9
 PHE-100   ALA-101  1.6 2.1 -11.6 18.3 22.9 21.4 -12.2
 ALA-101   ASN-102  1.9 1.6 -12.1 -2.5 49.6 45.6 -19.2
 ASN-102   LEU-103  1.1 1.5 -13.0 15.3 33.7 32.7 18.6
 LEU-103   ARG-104  1.1 0.8 0.8 -2.3 140.4 137.7 -27.2
 ARG-104   PRO-105  0.9 1.3 -12.9 -2.8 33.0 32.6 46.1
 PRO-105   ALA-106  1.5 1.0 12.0 -23.8 143.1 143.7 20.3
 ALA-106   LYS-107  0.2 0.3 1.4 -9.5 136.4 132.6 -0.5
 LYS-107   VAL-108  2.3 2.1 16.1 -13.4 151.3 150.5 0.4

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
 ASP-245   LEU-246  9.1 9.8 -0.8 -0.7 158.3 151.4 -5.6
 LEU-246   ALA-247  9.7 10.2 9.7 1.9 63.0 61.9 13.1
 ALA-247   SER-248  6.1 6.5 11.7 5.2 74.8 58.0 18.0
 SER-248   VAL-249  5.8 6.9 -0.6 14.5 151.8 168.4 59.8
 VAL-249   LEU-250  7.8 7.9 -3.6 -1.0 141.3 118.4 -8.4
 LEU-250   PRO-251  5.3 4.5 -28.4 0.5 118.6 113.5 -35.2
 PRO-251   GLY-252  3.6 3.4 -11.8 60.1 119.8 116.3 113.6
 GLY-252   SER-253  7.3 7.0 -28.7 4.5 76.9 60.5 20.9
 SER-253   LEU-254  8.9 9.5 27.1 -10.4 168.1 170.4 -42.2
 LEU-254   GLY-255  10.2 10.2 21.2 -0.4 104.8 104.0 -40.5

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