DNA Beta-Glucosyltransferase

(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  ASN-170   ASP-171  5.6 5.9 23.1 -6.2 104.8 108.0 -40.5  ASP-171   PHE-172  4.6 5.3 -14.1 10.9 135.2 131.4 1.0  PHE-172   GLN-173  3.4 3.8 0.9 -13.3 102.9 108.1 28.8 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  ASN-262   ASP-263  5.8 5.4 4.4 2.3 96.1 90.4 42.4  ASP-263   ASN-264  4.0 3.5 3.0 3.0 71.8 74.3 34.5  ASN-264   PHE-265  7.4 6.9 6.2 -3.5 9.7 14.5 21.0  PHE-265   ILE-266  7.8 7.5 4.0 -6.4 65.5 59.5 -42.7  ILE-266   THR-267  5.1 5.2 -7.3 -0.5 128.7 123.1 -15.1  THR-267   LEU-268  7.2 7.7 0.9 5.4 19.6 22.0 57.0  LEU-268   ARG-269  7.8 8.5 -7.6 4.7 92.7 92.8 0.9  ARG-269   VAL-270  8.4 8.9 7.1 0.0 97.7 95.1 -10.8  VAL-270   TRP-271  5.1 5.4 -3.3 -3.1 150.4 157.1 -39.6  TRP-271   GLU-272  3.6 4.4 -6.9 3.5 126.3 124.5 -15.5  GLU-272   THR-273  7.0 7.8 4.5 -4.5 104.6 102.1 0.0 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  LYS-333   THR-334  8.9 7.6 -9.6 -1.8 77.6 82.7 17.2  THR-334   ARG-335  6.5 5.8 1.0 10.0 32.8 28.6 72.3  ARG-335   ALA-336  5.6 5.1 -14.2 15.6 120.4 113.9 -5.4  ALA-336   LYS-337  9.1 8.6 -1.6 1.5 72.3 71.4 -2.5  LYS-337   LYS-338  10.7 10.1 -5.1 2.3 102.6 107.8 -0.6  LYS-338   ALA-339  9.7 9.5 0.2 -0.3 85.3 84.8 23.6  ALA-339   GLU-340  13.4 13.2 -3.8 2.2 28.7 31.0 5.6 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