3-Phosphoglycerate Kinase

(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  PRO-201   THR-202  7.2 7.2 23.7 6.5 57.0 50.3 146.4  THR-202   ARG-203  9.0 9.1 33.4 -40.4 33.2 38.1 -38.9  ARG-203   PRO-204  7.8 7.9 2.8 7.9 67.9 55.9 16.1 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

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  HIS-388   VAL-389  6.2 6.6 -1.2 3.3 76.3 73.5 -11.0  VAL-389   SER-390  7.8 8.1 17.0 -3.3 55.6 51.4 50.5  SER-390   THR-391  6.3 6.8 -8.9 38.3 118.5 127.5 100.9  THR-391   GLY-392  8.5 8.7 -48.6 35.0 91.9 75.5 -14.9  GLY-392   GLY-393  8.7 9.6 -80.9 65.9 68.4 59.9 -17.9  GLY-393   GLY-394  11.9 12.0 25.0 -13.6 119.7 114.9 -76.8  GLY-394   ALA-395  13.7 13.7 7.2 -1.3 90.4 81.7 -35.8  ALA-395   SER-396  11.2 10.9 -3.7 -0.8 43.0 44.7 -9.9  SER-396   LEU-397  8.5 8.3 -4.7 3.3 26.2 33.5 33.9  LEU-397   GLU-398  10.9 10.8 16.3 -19.1 97.0 91.1 -9.3  GLU-398   LEU-399  12.6 12.0 7.8 -2.0 97.8 96.6 -14.7  LEU-399   LEU-400  9.7 8.9 -1.8 6.2 18.1 13.0 -22.8  LEU-400   GLU-401  8.3 7.9 -6.4 9.7 47.7 55.6 -26.0  GLU-401   GLY-402  11.7 11.5 -29.8 -27.3 94.2 102.8 -56.7  GLY-402   LYS-403  12.7 11.7 70.6 -44.0 27.8 53.9 94.4  LYS-403   GLU-404  14.7 14.4 7.7 15.1 44.5 28.9 64.1  GLU-404   LEU-405  14.8 14.7 3.8 8.3 34.2 51.1 48.3  LEU-405   PRO-406  13.6 13.7 13.5 2.8 34.2 37.8 56.2  PRO-406   GLY-407  16.0 16.4 0.5 -15.4 43.5 36.9 -69.3 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