Chemical elements
  Bromine
    Isotopes
    Energy
    Production
    Application
    PDB 101d-1f5m
    PDB 1f6j-1kdh
    PDB 1kfo-1o3l
    PDB 1o5m-1to3
    PDB 1uhj-1zpz
    PDB 1zw9-2fkk
    PDB 2fpr-2j9m
    PDB 2ja5-2qfe
    PDB 2qgd-2wb9
    PDB 2wbb-3biy
    PDB 3bm9-3eki
    PDB 3en9-3hvo
    PDB 3hzw-3lbz
      3hzw
      3i03
      3i18
      3i32
      3i4m
      3i4n
      3i4u
      3i5y
      3ibk
      3il2
      3il5
      3imr
      3ims
      3imt
      3imu
      3imv
      3imw
      3iti
      3ivn
      3ix4
      3ix8
      3jpq
      3jpu
      3jqc
      3js7
      3jtk
      3jum
      3jun
      3juo
      3jup
      3juq
      3jzk
      3k1w
      3k3i
      3k9u
      3kde
      3khj
      3kku
      3klc
      3kqm
      3kvw
      3kxg
      3kxh
      3kxj
      3kxm
      3l8s
      3lb2
      3lbo
      3lbw
      3lbz
    PDB 3ld5-3ot3
    PDB 3oyp-4de3
    PDB 4dey-9est

Bromine in the structure of Cruzain in Complex With A Non-Covalent Ligand (pdb 3kku)






The binding sites of Bromine atom in the structure of Cruzain in Complex With A Non-Covalent Ligand (pdb code 3kku). This binding sites where shown with 5.0 Angstroms radius around Bromine atom.
The 3kku structure was solved by R.S.FERREIRA, O.EIDAM, B.K.SHOICHET, with X-Ray Crystallography technique, brief refinement statistics is given in the table below:
Resolution (A)30.7-1.3
Space groupP6522
a (A)82.978
b (A)82.978
c (A)101.733
alpha (°)90.00
beta (°)90.00
gamma (°)120.00
Rfactor (%)11.5
Rfree (%)14.4


Bromine Binding Sites:

Bromine binding site 1 out of 1 in 3kku


Bromine binding site 1 out of 1 in 3kku
Click to enlarge
stereopicture of Bromine binding site 1 out of 1 in 3kku
Click to enlarge
Mono- and Stereo- picture of 5.0 Angstrom coordination sphere 1 of Bromine in the PDB 3kku. Coordination sphere was calculated for all residues within 5.0 Angstroms distance from the central Bromine atom, shown by VdW sphere
Residues shown as a stick model or VDW spheres: A: Trp26, A: Gly66, A: Leu67, A: Met68, A: Ala138, A: His162, A: Gly163, A: B95216, A: Hoh292,

conact list:


AtomAtomDistance (A)
BrCB A:Trp264.82
BrO A:Gly664.04
BrCD2 A:Leu674.21
BrCA A:Leu674.54
BrN A:Met684.66
BrCE A:Met683.60
BrSD A:Met683.31
BrN A:Ala1384.89
BrCB A:Ala1383.63
BrCA A:Ala1384.21
BrO A:His1624.38
BrC A:His1624.35
BrN A:Gly1634.15
BrCA A:Gly1634.11
BrBRAB A:B952160.00
BrCAD A:B952164.63
BrCAR A:B952164.77
BrCAC A:B952164.13
BrOAQ A:B952163.07
BrCAU A:B952162.86
BrCAS A:B952161.89
BrCAH A:B952164.15
BrCAG A:B952162.83
BrCAM A:B952163.27
BrO A:Hoh2924.73

interactive model:




© Copyright 2008-2012 by atomistry.com