Alcohol 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  GLY-175   PHE-176  2.8 2.6 -1.5 1.7 86.2 86.2 10.3  PHE-176   SER-177  1.0 1.2 -3.4 2.9 24.7 23.8 -19.3  SER-177   THR-178  2.3 2.5 -8.0 7.1 46.9 45.0 14.5 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  VAL-288   SER-289  14.7 14.7 0.3 -1.4 137.3 134.1 -9.8  SER-289   VAL-290  13.5 13.5 -2.2 9.6 89.5 92.6 51.6  VAL-290   ILE-291  9.9 10.0 1.7 13.3 122.3 117.8 -121.8  ILE-291   SER-292  9.4 9.9 -29.2 24.3 70.9 60.5 97.6  SER-292   GLY-293  7.1 7.9 -28.3 64.1 72.1 72.0 -92.2  GLY-293   VAL-294  9.8 10.7 33.4 37.1 47.1 50.5 576.8  VAL-294   PRO-295  12.1 12.2 9.2 -27.6 103.4 85.7 95.9  PRO-295   PRO-296  14.7 15.6 28.2 -12.9 35.5 89.9 59.4  PRO-296   ASP-297  15.6 18.8 169.8 45.7 64.7 27.0 -1403.9  ASP-297   SER-298  19.0 19.2 110.4 123.5 71.9 40.0 1752.0  SER-298   GLN-299  18.0 20.0 -122.4 -22.7 145.7 96.0 -730.0  GLN-299   ASN-300  20.5 20.8 -54.7 -9.7 123.1 117.7 -291.7  ASN-300   LEU-301  19.6 19.8 5.9 2.6 114.1 112.5 15.0  LEU-301   SER-302  19.7 19.9 -2.5 -2.8 141.3 146.0 -57.0 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  ALA-317   ILE-318  2.9 3.2 -10.8 8.0 45.4 45.6 -15.5  ILE-318   PHE-319  3.2 3.5 -9.5 3.5 60.9 58.4 115.0  PHE-319   GLY-320  2.2 2.2 -1.8 0.5 93.2 97.0 -37.1 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