3-Dehydroquinate Synthase

(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
 THR-5   LYS-6  7.5 7.3 17.3 -16.8 107.5 104.4 22.0
 LYS-6   ILE-7  5.5 5.3 0.5 9.6 105.7 108.2 -13.2
 ILE-7   SER-8  1.9 1.9 37.3 -37.3 119.5 127.1 25.4
 SER-8   ILE-9  3.0 3.1 -16.5 10.1 74.7 77.7 14.3
 SER-8   ILE-9  3.0 3.1 -16.5 10.1 74.7 77.7 14.3

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


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-8   ILE-9  3.0 3.1 -16.5 10.1 74.7 77.7 14.3
 SER-8   ILE-9  3.0 3.1 -16.5 10.1 74.7 77.7 14.3
 ILE-9   LEU-10  5.7 6.2 2.5 -14.3 49.9 50.6 -80.0
 LEU-10   GLY-11  8.4 9.0 17.1 -5.0 32.6 43.4 124.1

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-14   ILE-15  8.2 8.4 51.0 -17.6 35.0 25.3 252.2
 ILE-15   ILE-16  6.0 6.0 -13.6 9.2 90.4 92.0 21.5
 ILE-16   ALA-17  7.6 7.4 5.2 5.2 22.8 20.9 98.7

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-183   PRO-184  4.8 5.1 -2.5 -2.2 37.5 36.1 39.6
 PRO-184   VAL-185  3.6 3.9 11.2 -7.3 76.2 77.0 -1.7
 VAL-185   ARG-186  1.0 1.2 0.8 -0.8 74.1 72.2 7.2

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
 ALA-220   VAL-221  9.1 9.0 7.0 -9.5 74.9 74.3 33.6
 VAL-221   ARG-222  5.4 5.3 -23.9 29.2 168.4 169.0 48.2
 ARG-222   ARG-223  5.8 5.6 17.7 4.0 62.2 57.9 108.5
 ARG-223   GLU-224  8.9 8.0 -3.6 -4.7 96.4 114.0 -19.3
 GLU-224   VAL-225  9.1 7.4 -8.7 -22.2 57.8 73.1 159.4
 VAL-225   THR-226  11.5 9.5 43.7 -26.9 67.7 64.9 64.8
 THR-226   PRO-227  14.6 11.6 17.3 -3.4 134.1 139.9 -102.0
 PRO-227   GLY-228  16.2 12.4 -6.9 4.1 59.8 52.7 43.5
 GLY-228   GLU-229  18.4 14.2 -48.9 58.7 62.7 66.9 48.0
 GLU-229   HIS-230  16.2 13.5 -9.0 6.7 62.6 57.2 -10.1
 HIS-230   ARG-231  13.3 11.6 47.3 -96.9 67.6 75.3 -133.5
 ARG-231   PHE-232  10.2 10.0 -121.3 161.7 60.9 17.6 -265.9
 PHE-232   GLU-233  10.6 9.6 -20.0 -53.9 68.5 66.4 163.4
 GLU-233   GLY-234  14.4 13.3 -166.6 175.7 45.5 79.1 -80.0
 GLY-234   THR-235  15.8 15.2 33.9 -57.6 54.4 73.9 -18.0
 GLY-234   THR-235  15.8 15.2 33.9 -57.6 54.4 73.9 -18.0

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
 GLY-234   THR-235  15.8 15.2 33.9 -57.6 54.4 73.9 -18.0
 GLY-234   THR-235  15.8 15.2 33.9 -57.6 54.4 73.9 -18.0
 THR-235   GLU-236  12.9 12.2 0.2 -24.5 42.8 47.3 -149.1
 GLU-236   GLU-237  11.6 10.5 15.4 6.5 29.9 24.3 184.9

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
 SER-246   ALA-247  6.0 6.0 6.5 -8.9 121.9 125.3 14.7
 ALA-247   ARG-248  3.4 3.6 -1.9 -3.1 10.2 13.8 37.5
 ARG-248   HIS-249  3.7 4.0 5.8 -6.2 106.8 102.9 1.2

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
 VAL-253   VAL-254  10.9 11.5 -8.2 6.9 106.3 104.8 -3.3
 VAL-254   SER-255  10.9 11.7 -18.8 21.1 162.6 165.8 24.9
 SER-255   ALA-256  9.5 10.4 -36.3 15.2 131.2 124.5 -163.4
 GLY-261   GLY-262  18.9 22.0 36.5 -82.4 153.3 96.1 155.4
 GLY-262   LEU-263  20.2 21.4 -90.5 38.3 59.4 59.5 285.4
 LEU-263   ARG-264  16.8 18.2 -30.8 27.7 36.3 26.1 62.6
 ARG-264   ASN-265  16.3 16.8 13.4 4.0 140.3 145.8 -145.7
 ASN-265   LEU-266  19.4 19.7 -0.4 3.3 52.5 54.9 24.9

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