Nad Dependent Epimerase/dehydratase

(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-173   LEU-174  4.0 4.0 -2.0 1.4 69.9 69.7 -5.0
 LEU-174   ILE-175  4.2 4.2 -0.5 1.1 123.4 123.4 5.4
 ILE-175   SER-176  4.5 4.5 -2.1 -1.1 81.8 82.3 107.4
 SER-176   HIS-177  8.1 8.2 0.7 -3.2 131.5 133.2 45.8
 SER-176   HIS-177  8.1 8.2 0.7 -3.2 131.5 133.2 45.8

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
 SER-176   HIS-177  8.1 8.2 0.7 -3.2 131.5 133.2 45.8
 SER-176   HIS-177  8.1 8.2 0.7 -3.2 131.5 133.2 45.8
 HIS-177   LYS-178  10.9 11.1 4.6 -4.5 114.0 113.3 -130.6
 LYS-178   THR-179  13.3 13.3 2.9 -9.3 151.8 151.7 264.7
 THR-179   PRO-180  11.8 11.8 -0.9 1.1 55.6 59.2 50.6
 PRO-180   PRO-181  10.0 9.7 0.9 -3.0 85.6 85.4 -124.5
 PRO-181   GLY-182  6.2 5.9 15.7 -14.6 124.7 129.5 -27.8
 GLY-182   GLY-183  5.9 5.4 4.3 12.6 109.1 106.8 157.8
 GLY-183   GLY-184  3.6 3.5 -6.0 7.6 114.1 123.9 -4.0
 GLY-184   THR-185  5.0 5.2 -8.5 -4.4 110.4 112.0 -169.3
 THR-185   THR-186  5.2 5.3 7.7 -1.7 46.9 47.2 102.0
 THR-186   ASP-187  3.1 3.1 0.6 -2.2 77.7 75.1 160.2
 THR-186   ASP-187  3.1 3.1 0.6 -2.2 77.7 75.1 160.2

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
 THR-186   ASP-187  3.1 3.1 0.6 -2.2 77.7 75.1 160.2
 THR-186   ASP-187  3.1 3.1 0.6 -2.2 77.7 75.1 160.2
 ASP-187   TYR-188  1.3 1.2 -0.4 1.7 107.0 106.9 -47.1
 TYR-188   ALA-189  2.5 2.6 0.7 -3.5 134.9 136.0 57.5

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


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
 TYR-202   THR-203  10.5 10.6 -2.7 -0.9 73.8 74.1 169.0
 THR-203   CYS-204  9.3 9.6 1.8 2.7 58.3 58.9 89.2
 CYS-204   PHE-205  8.2 8.3 1.8 -0.2 113.0 113.9 22.7

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
 LEU-206   LYS-207  9.7 9.6 -1.0 2.7 81.1 80.5 -5.2
 LYS-207   GLU-208  13.1 13.1 -1.8 -1.4 41.8 42.2 234.7
 GLU-208   ASP-209  13.9 13.8 2.6 -0.5 162.3 162.3 -159.7

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
 GLU-210   ALA-211  12.2 12.3 2.4 -2.8 48.5 47.9 24.2
 ALA-211   LEU-212  10.5 10.5 2.3 -2.5 91.8 92.6 0.5
 LEU-212   PRO-213  7.8 7.7 -0.1 -0.4 140.6 139.2 18.1

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
 SER-247   PHE-248  6.4 6.3 0.6 1.6 67.1 68.4 49.8
 PHE-248   THR-249  8.2 8.1 0.2 0.3 24.8 25.4 -6.8
 THR-249   PRO-250  10.1 10.1 1.5 -0.8 53.7 54.2 34.6

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
 ILE-266   ARG-267  13.7 13.9 -2.2 11.3 58.9 59.5 -321.6
 ARG-267   TYR-268  13.8 14.0 -9.3 4.3 87.3 94.3 329.0
 TYR-268   GLU-269  12.8 13.0 -3.1 -0.6 33.8 34.0 113.6

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
 GLN-298   TYR-299  5.3 5.4 2.0 2.8 50.5 49.3 223.8
 TYR-299   GLY-300  5.6 5.7 -0.7 1.3 104.3 103.3 -11.2
 GLY-300   LEU-301  5.7 5.8 -0.2 1.2 148.1 148.8 -5.1

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