Atp Sulfurylase

(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-225   VAL-226  9.7 9.7 2.7 -9.7 32.7 25.4 -37.2
 VAL-226   VAL-227  11.4 11.3 19.2 -23.9 60.9 58.2 -80.9
 VAL-227   GLY-228  9.5 10.3 140.0 -5.2 39.1 40.1 536.5
 GLY-228   LEU-229  12.4 12.5 -73.9 58.0 77.9 141.8 0.0
 LEU-229   THR-230  15.0 11.2 7.1 48.2 166.3 101.8 -218.8
 THR-230   LYS-231  15.5 8.7 -76.5 -16.2 73.4 125.6 -10.3
 LYS-231   PRO-232  17.8 10.8 -38.6 7.5 115.3 91.7 -73.5
 PRO-232   GLY-233  19.2 8.8 24.4 -15.1 101.7 125.4 -28.6
 GLY-233   ASP-234  17.6 11.1 -6.2 -1.1 65.9 25.7 53.3
 ASP-234   ILE-235  14.0 11.1 -103.5 19.2 120.6 47.7 -10.5
 ILE-235   ASP-236  11.1 10.0 -170.6 -1.0 147.4 31.1 -64.4
 ASP-236   HIS-237  10.0 9.9 160.0 15.4 96.8 88.2 53.1
 HIS-237   PHE-238  7.1 7.4 -27.0 0.5 96.9 86.1 -17.1

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
 ARG-240   VAL-241  4.6 4.9 -6.2 1.4 78.4 84.7 -0.3
 VAL-241   ARG-242  2.0 1.9 -5.5 1.6 110.5 114.6 -20.1
 ARG-242   ALA-243  2.0 2.4 6.0 3.6 10.6 7.2 59.2

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
 LEU-385   ARG-386  8.9 8.0 11.6 -6.3 88.6 91.0 11.0
 ARG-386   GLU-387  12.3 11.6 -6.6 17.9 156.3 152.8 60.0
 GLU-387   SER-388  12.5 12.3 14.6 -0.7 56.7 57.2 54.0

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