Tyrosine-Protein Kinase Btk

(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
 ILE-429   LYS-430  11.3 11.2 9.3 -12.3 102.9 101.7 56.1
 LYS-430   MET-431  11.9 12.5 -2.8 -1.2 95.9 93.8 62.2
 MET-431   ILE-432  15.6 16.1 -4.8 -14.8 98.1 92.1 -56.3
 ILE-432   LYS-433  17.8 18.1 57.7 -95.5 114.1 101.3 101.1
 LYS-433   GLU-434  20.8 21.9 7.4 -38.4 53.5 67.0 -139.7
 PHE-442   ILE-443  18.0 18.2 0.7 37.8 70.8 7.0 261.7
 ILE-443   GLU-444  18.4 19.8 7.7 -52.9 18.8 54.7 -318.2
 GLU-444   GLU-445  18.0 16.7 8.3 8.7 85.9 110.2 -144.9
 GLU-445   ALA-446  15.0 13.7 -25.2 -11.8 66.7 106.8 -7.8
 ALA-446   LYS-447  13.5 12.6 -1.0 4.4 133.8 173.7 13.0
 LYS-447   VAL-448  13.5 13.4 -5.0 10.1 118.8 112.4 31.3
 VAL-448   MET-449  10.9 10.9 -11.0 3.6 51.1 77.8 31.4
 MET-449   MET-450  8.9 8.4 10.2 -11.2 98.3 59.6 -45.3
 MET-450   ASN-451  9.1 9.7 4.5 -12.2 49.3 32.5 -41.0
 ASN-451   LEU-452  7.2 7.8 4.3 -44.3 95.0 94.6 -13.3
 LEU-452   SER-453  4.1 4.5 4.4 -0.7 123.7 121.7 -4.8
 SER-453   HIS-454  2.5 2.4 6.6 2.8 87.2 85.3 -20.6
 HIS-454   GLU-455  2.5 2.1 6.2 3.6 159.9 151.3 -95.8
 GLU-455   LYS-456  5.0 4.8 -1.2 -2.1 48.0 49.2 29.5
 LYS-456   LEU-457  4.7 4.3 4.9 -4.8 94.7 99.7 37.8
 LEU-457   VAL-458  2.0 1.8 3.8 0.0 127.0 127.6 -75.0

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
 ILE-473   THR-474  11.2 11.2 6.1 4.9 63.7 59.0 79.8
 THR-474   GLU-475  7.6 7.6 10.5 -21.5 116.6 116.7 121.6
 GLU-475   TYR-476  5.4 5.9 13.4 -2.2 156.3 147.1 -134.7
 TYR-476   MET-477  4.7 4.8 5.5 5.3 95.5 91.9 -2.5
 MET-477   ALA-478  1.4 1.7 4.0 -4.1 164.9 165.2 0.4
 ALA-478   ASN-479  2.8 3.3 4.1 -2.4 119.6 118.3 5.3

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


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-537   SER-538  6.0 5.9 -2.2 2.0 96.5 97.9 -2.9
 SER-538   ASP-539  6.4 6.2 11.3 -6.0 100.5 100.9 -26.3
 ASP-539   PHE-540  9.7 9.6 5.6 -28.7 152.0 153.6 193.7
 PHE-540   GLY-541  9.8 9.8 -123.3 -160.9 62.3 63.3 -262.0
 PHE-559   PRO-560  23.7 23.5 -5.2 -9.9 98.6 104.5 -38.4
 PRO-560   VAL-561  21.7 21.6 7.3 4.4 114.1 107.0 11.9
 VAL-561   ARG-562  25.0 24.9 -4.9 0.3 89.6 89.1 -28.1

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