Malonyl Coa Synthetase

(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
 LEU-395   GLY-396  3.5 3.9 45.5 -57.6 97.6 79.5 7.3
 GLY-396   ARG-397  4.0 4.3 16.8 -42.7 62.3 44.0 -35.6
 ARG-397   GLY-398  7.4 6.9 -131.4 144.0 159.7 144.0 34.7
 ASP-400   LEU-401  6.9 5.8 27.9 4.0 53.5 50.3 60.9
 LEU-401   VAL-402  4.8 4.3 3.0 -5.0 69.8 77.8 11.5
 VAL-402   ILE-403  6.9 6.6 15.5 -16.3 25.2 27.6 4.0
 ILE-403   THR-404  7.1 7.1 -6.9 23.8 103.0 102.9 0.9
 THR-404   GLY-405  9.9 9.9 -9.0 4.9 133.2 146.5 1.3
 GLY-405   GLY-406  11.2 10.9 -4.0 -1.0 119.1 117.4 -2.3
 GLY-406   PHE-407  7.7 7.4 2.0 4.0 124.4 117.8 -1.8

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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