Bifunctional P-450/nadph-P450 Reductase

(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
 ARG-167   ASP-168  11.6 11.6 -1.2 -8.9 13.3 13.5 77.2
 ASP-168   GLN-169  11.4 11.0 18.4 -16.6 105.4 99.9 -54.0
 GLN-169   PRO-170  7.7 7.4 -2.2 10.6 128.3 139.5 40.8
 PRO-170   HIS-171  5.1 4.8 -1.3 2.4 150.4 152.6 -15.5
 HIS-171   PRO-172  4.8 4.9 8.3 -9.1 85.8 84.5 8.7
 PRO-172   PHE-173  3.1 3.9 1.4 5.9 69.3 69.6 2.1
 PHE-173   ILE-174  0.5 0.6 2.6 -13.6 140.9 136.9 36.4
 ILE-174   THR-175  2.4 1.4 8.4 -8.3 124.5 130.4 -8.9

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


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-214   LEU-215  3.9 4.0 -12.0 1.1 90.7 90.1 19.9
 LEU-215   VAL-216  0.5 0.8 -0.7 -5.6 43.5 48.5 17.7
 VAL-216   ASP-217  2.6 2.4 0.5 6.1 153.8 156.5 -9.3
 ASP-217   LYS-218  1.5 1.3 -8.4 -1.1 81.3 79.1 16.9
 LYS-218   ILE-219  2.5 2.7 -2.2 8.1 75.1 83.7 6.6
 ILE-219   ILE-220  4.0 4.2 -5.7 4.1 14.6 19.4 18.5
 ILE-220   ALA-221  3.1 3.8 6.3 -21.7 127.0 133.3 37.7
 ALA-221   ASP-222  2.9 3.1 9.9 -3.0 94.7 90.9 -18.7
 ASP-222   ARG-223  6.4 6.7 5.0 4.2 126.3 116.8 -33.8
 ARG-223   LYS-224  7.4 7.9 -11.5 7.2 15.9 6.7 29.6
 LYS-224   ALA-225  5.4 6.3 9.0 -14.7 108.5 116.4 15.1
 ALA-225   SER-226  7.7 7.9 9.8 -6.4 94.4 89.8 -10.0
 SER-230   ASP-231  15.9 16.0 13.2 -7.9 102.0 95.1 -12.0
 ASP-231   ASP-232  17.5 17.7 1.3 -0.8 26.6 17.9 -8.1
 ASP-232   LEU-233  16.3 16.4 -4.9 5.8 91.0 89.4 -9.3

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