Immunoglobulin Fab Fragment (Mc/pc603)

(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
 SER-10   LEU-11  11.3 11.2 -1.1 -5.3 163.4 159.8 -70.7
 LEU-11   SER-12  10.6 11.1 23.6 -14.2 76.7 57.3 19.1
 SER-12   VAL-13  8.9 9.2 41.5 -30.4 7.2 15.4 60.9
 VAL-13   SER-14  8.0 8.7 -2.8 -6.2 110.6 111.3 -35.1
 SER-14   ALA-15  6.2 6.1 175.5 -148.5 63.3 66.5 -28.5

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
 LYS-109   LEU-110  8.4 8.5 -8.2 11.5 157.1 156.8 22.8
 LEU-110   GLU-111  7.1 7.4 1.9 5.0 94.9 93.0 33.3
 GLU-111   ILE-112  4.7 5.3 -9.5 4.5 160.6 172.5 3.1

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-168   TRP-169  8.4 8.3 28.2 -38.9 177.1 173.3 0.1
 TRP-169   THR-170  7.1 6.8 2.4 -2.8 100.2 112.1 49.1
 THR-170   ASP-171  6.0 5.6 -28.5 9.5 60.5 67.1 81.6

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
 ASP-173   SER-174  5.3 4.5 9.7 7.9 41.6 41.1 120.0
 SER-174   LYS-175  5.1 4.6 -42.6 30.6 147.1 146.8 -54.4
 LYS-175   ASP-176  6.8 6.7 -4.9 2.8 113.7 112.4 -76.6

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