Isochorismate Synthase/isochorismate-Pyruvate Lyase Mbti

(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
 TYR-249   SER-250  25.7 25.4 8.7 -0.5 99.4 100.2 -88.8
 SER-250   PRO-251  22.0 21.7 -9.1 3.3 62.0 57.2 161.1
 PRO-251   GLU-252  19.7 19.5 13.0 3.5 68.5 70.1 124.6
 GLU-252   LEU-253  16.5 16.3 -10.1 -10.7 152.2 169.6 -306.1
 LEU-253   VAL-254  15.0 15.0 -16.0 12.0 78.9 93.4 131.2
 VAL-254   THR-255  13.2 13.2 -16.5 -2.1 139.8 133.4 -183.1

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
 VAL-262   VAL-263  7.6 8.0 -4.9 8.6 63.0 61.0 47.3
 VAL-263   ILE-264  7.1 7.2 -1.3 -2.9 18.8 21.6 131.1
 ILE-264   THR-265  8.9 8.9 2.7 1.3 122.2 124.4 -143.8
 THR-265   GLU-266  9.2 9.1 -13.7 3.7 150.5 147.8 -224.0
 THR-265   GLU-266  9.2 9.1 -13.7 3.7 150.5 147.8 -224.0

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
 THR-265   GLU-266  9.2 9.1 -13.7 3.7 150.5 147.8 -224.0
 THR-265   GLU-266  9.2 9.1 -13.7 3.7 150.5 147.8 -224.0
 GLU-266   PRO-267  11.0 10.8 -2.5 2.1 144.4 142.9 11.4
 PRO-267   LEU-268  10.0 10.1 12.2 9.6 42.1 38.5 319.3
 LEU-268   ALA-269  12.4 11.9 32.9 -3.2 42.6 38.7 241.0
 ALA-269   GLY-270  11.4 10.9 -48.9 20.6 143.2 140.2 -399.2

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-299   ILE-300  2.9 2.0 -3.0 2.2 65.7 63.3 -38.5
 ILE-300   SER-301  3.5 3.1 -5.1 0.5 33.6 34.2 63.0
 SER-301   VAL-302  5.9 5.2 -4.1 3.6 37.2 40.4 44.5
 VAL-302   ARG-303  3.7 3.1 2.5 -7.3 68.9 66.6 9.8
 VAL-302   ARG-303  3.7 3.1 2.5 -7.3 68.9 66.6 9.8

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
 VAL-302   ARG-303  3.7 3.1 2.5 -7.3 68.9 66.6 9.8
 VAL-302   ARG-303  3.7 3.1 2.5 -7.3 68.9 66.6 9.8
 ARG-303   SER-304  1.8 1.5 6.8 0.9 54.0 56.0 80.7
 SER-304   SER-305  5.4 4.9 2.5 -0.1 27.7 28.3 31.6
 SER-305   LEU-306  5.2 4.3 -6.3 1.6 127.9 127.3 -53.0
 LEU-306   GLU-307  1.7 0.9 -7.1 0.6 114.3 112.7 -76.4

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-317   ALA-318  5.3 5.7 -5.6 3.2 41.9 37.2 46.4
 ALA-318   ALA-319  3.1 3.7 3.5 -10.9 136.8 137.1 70.1
 ALA-319   VAL-320  5.7 6.1 4.8 -4.4 123.4 124.0 -53.7

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
 THR-338   ILE-339  9.7 9.6 -5.2 10.3 68.1 68.2 56.5
 ILE-339   ARG-340  6.4 6.2 -13.4 6.4 5.4 8.6 75.0
 ARG-340   ALA-341  6.3 6.5 0.7 -6.5 113.0 118.2 -56.5

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