Acetaldehyde Dehydrogenase (Acylating)

(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
 ASP-77   ALA-78  13.8 13.9 11.4 -10.3 134.6 130.7 40.6
 ALA-78   THR-79  13.7 14.0 24.1 -17.7 104.6 101.7 24.0
 THR-79   SER-80  17.1 17.5 129.0 -68.2 83.5 80.5 -12.3
 SER-80   ALA-81  18.0 18.3 -179.3 5.5 121.0 169.5 -1294.7
 ALA-81   SER-82  21.1 17.7 158.6 25.6 27.9 53.2 1438.5
 SER-82   ALA-83  20.8 21.0 108.3 -133.7 58.5 88.5 -68.2
 ALA-83   HIS-84  21.6 20.8 -53.6 4.7 95.9 119.0 -115.0
 HIS-84   VAL-85  18.0 17.5 -1.1 15.4 155.1 163.7 104.5
 VAL-85   GLN-86  18.4 18.9 -24.2 -4.0 93.8 97.6 -70.5
 GLN-86   ASN-87  21.7 21.6 5.8 -1.0 115.8 108.7 -36.1
 ASN-87   GLU-88  20.2 19.7 -1.6 0.6 128.4 133.5 -26.9
 GLU-88   ALA-89  17.6 17.2 -4.4 12.3 134.9 135.1 40.6

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
 ILE-101   ASP-102  9.0 9.1 -8.7 13.8 64.8 66.9 -10.9
 ASP-102   LEU-103  10.2 10.2 -4.3 -14.2 51.1 44.2 102.8
 LEU-103   THR-104  9.7 9.9 8.8 4.9 87.1 91.9 59.1
 THR-104   PRO-105  12.5 13.0 36.8 -26.7 143.7 132.3 -92.0
 THR-104   PRO-105  12.5 13.0 36.8 -26.7 143.7 132.3 -92.0

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-104   PRO-105  12.5 13.0 36.8 -26.7 143.7 132.3 -92.0
 THR-104   PRO-105  12.5 13.0 36.8 -26.7 143.7 132.3 -92.0
 PRO-105   ALA-106  12.0 13.5 -116.7 30.9 42.2 26.4 593.0
 ALA-106   ALA-107  13.1 14.9 161.2 126.5 108.5 138.8 330.0
 ALA-107   ILE-108  15.4 11.8 89.0 18.8 134.1 157.4 -821.8
 ILE-108   GLY-109  13.0 12.3 -152.4 -16.0 106.8 69.9 -22.8
 GLY-109   PRO-110  9.4 8.6 -0.7 24.3 39.3 102.4 -144.1
 PRO-110   TYR-111  6.4 5.8 -0.3 47.5 161.4 161.5 354.7
 TYR-111   CYS-112  5.6 5.6 -19.7 -16.3 106.4 104.2 -103.1
 CYS-112   VAL-113  2.7 2.7 -9.5 0.8 153.4 156.3 -57.0
 VAL-113   PRO-114  4.1 4.1 1.0 3.9 87.0 86.6 -20.1

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-116   ASN-117  7.9 8.1 2.6 -11.7 145.7 141.9 51.5
 ASN-117   LEU-118  5.5 5.5 9.7 4.0 86.8 82.3 41.8
 LEU-118   GLU-119  4.2 4.3 -2.8 -9.3 38.8 38.5 28.4

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
 ASN-126   VAL-127  8.6 9.3 -26.6 16.1 69.2 79.0 -58.7
 VAL-127   ASN-128  5.9 6.3 10.5 8.1 128.7 135.5 -91.9
 ASN-128   MET-129  7.1 7.4 5.3 -5.6 129.1 131.3 -23.2

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
 GLU-278   GLY-279  6.5 6.3 -2.2 -16.0 67.8 67.4 55.7
 GLY-279   ALA-280  3.9 3.6 16.3 -7.0 55.1 47.6 55.8
 ALA-280   ALA-281  0.7 1.4 4.6 4.0 47.6 50.2 32.9

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
 TYR-287   ALA-288  9.4 9.0 -20.5 5.7 152.9 161.9 -80.6
 ALA-288   GLY-289  9.4 9.0 11.0 -9.6 45.3 48.9 5.9
 GLY-289   ASN-290  7.4 6.7 16.2 -3.0 21.5 20.2 83.6
 ASN-290   LEU-291  9.7 8.9 2.7 19.3 110.3 109.9 -91.2
 ASN-290   LEU-291  9.7 8.9 2.7 19.3 110.3 109.9 -91.2

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
 ASN-290   LEU-291  9.7 8.9 2.7 19.3 110.3 109.9 -91.2
 ASN-290   LEU-291  9.7 8.9 2.7 19.3 110.3 109.9 -91.2
 LEU-291   ASP-292  8.8 7.7 -14.5 12.7 89.7 69.9 13.6
 ASP-292   ILE-293  5.2 3.9 -10.1 2.6 40.7 33.1 33.2
 ILE-293   MET-294  4.3 4.5 1.1 -13.5 144.6 147.3 72.5
 MET-294   THR-295  5.6 5.4 -6.5 4.7 91.8 91.0 71.3

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