Dihydroflavonol 4-Reductase

(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
 GLY-80   VAL-81  7.7 7.6 -0.6 -0.3 106.2 106.6 64.9
 VAL-81   PHE-82  3.9 3.8 -6.4 1.5 34.7 38.4 85.4
 PHE-82   HIS-83  2.7 2.7 1.2 -2.7 78.5 76.9 -38.4
 HIS-83   VAL-84  2.0 2.1 0.5 -3.7 122.4 123.5 107.2
 VAL-84   ALA-85  5.5 5.6 -3.5 5.0 103.6 104.5 -58.0

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
 MET-107   LEU-108  8.4 8.5 -3.3 2.9 79.8 79.1 -270.1
 LEU-108   GLY-109  10.9 11.0 1.1 -4.8 159.0 158.4 98.2
 GLY-109   ILE-110  10.5 10.5 -0.1 0.8 84.1 82.6 121.8
 ILE-110   MET-111  6.9 7.0 -0.9 0.3 115.1 115.4 -82.8
 MET-111   LYS-112  8.6 8.7 0.6 8.0 128.6 125.9 -228.7
 LYS-112   SER-113  11.4 11.5 -1.5 -8.4 40.9 46.6 345.2
 SER-113   CYS-114  8.8 9.1 0.9 1.0 73.9 69.6 29.6
 CYS-114   ALA-115  8.6 8.7 3.1 -1.0 89.1 85.8 151.2
 ALA-115   ALA-116  12.4 12.5 10.5 -12.9 158.0 150.8 -11.3
 ALA-116   ALA-117  12.8 13.1 5.3 -17.3 113.3 109.5 51.0
 ALA-117   LYS-118  10.9 11.2 115.5 -127.9 81.7 54.4 -397.6
 LYS-118   THR-119  14.0 14.4 4.1 24.1 73.0 76.5 423.6
 THR-119   VAL-120  12.7 13.2 -15.2 7.9 144.5 143.5 -227.3
 VAL-120   ARG-121  10.3 10.4 -2.4 3.8 147.6 151.3 46.1
 ARG-121   ARG-122  12.1 12.1 10.1 -13.7 38.2 39.7 -68.0
 ARG-122   LEU-123  8.9 8.9 1.5 4.3 110.0 109.0 -173.4

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
 THR-126   SER-127  3.7 3.9 -1.7 2.5 63.9 66.2 80.2
 SER-127   SER-128  5.1 5.3 5.1 -7.0 108.1 109.0 109.6
 SER-128   ALA-129  8.1 8.1 6.3 2.3 172.9 172.1 -233.5

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
 THR-131   VAL-132  9.4 9.4 -5.9 2.5 157.0 161.0 3.9
 VAL-132   ASN-133  8.0 8.2 1.9 -7.2 41.7 39.5 -182.7
 ASN-133   ILE-134  10.7 10.8 7.9 4.0 94.0 94.7 344.6

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
 TYR-142   ASP-143  5.5 5.5 -5.5 9.5 111.7 111.6 -49.6
 ASP-143   GLU-144  2.1 2.0 6.1 -6.2 47.6 47.2 -37.2
 GLU-144   SER-145  1.2 1.2 10.1 -7.9 103.7 103.8 13.1

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
 ASN-182   ILE-183  15.5 15.5 0.6 -4.4 123.8 122.2 121.9
 ILE-183   ASP-184  12.1 12.0 4.1 -4.3 44.9 45.4 7.3
 ASP-184   PHE-185  10.8 10.6 -4.3 2.4 85.5 85.9 -50.9

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