Chemical elements
  Bromine
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    PDB 101d-1f5m
    PDB 1f6j-1kdh
    PDB 1kfo-1o3l
    PDB 1o5m-1to3
    PDB 1uhj-1zpz
    PDB 1zw9-2fkk
    PDB 2fpr-2j9m
      2fpr
      2fsx
      2fwy
      2fza
      2g2p
      2g91
      2ga2
      2giu
      2glp
      2gmx
      2got
      2goz
      2gpx
      2grb
      2gun
      2h05
      2h34
      2h4g
      2h4k
      2h7l
      2hb1
      2hc0
      2hek
      2hg3
      2hg9
      2hh1
      2hhk
      2hi8
      2hit
      2hj6
      2hlf
      2ht2
      2ht3
      2ht4
      2htk
      2htl
      2hwp
      2hyp
      2i16
      2i17
      2iki
      2iuo
      2ivu
      2j18
      2j19
      2j3s
      2j4a
      2j5f
      2j6l
      2j9m
    PDB 2ja5-2qfe
    PDB 2qgd-2wb9
    PDB 2wbb-3biy
    PDB 3bm9-3eki
    PDB 3en9-3hvo
    PDB 3hzw-3lbz
    PDB 3ld5-3ot3
    PDB 3oyp-4de3
    PDB 4dey-9est

Bromine in the structure of Crystal Structure of PTP1B With Monocyclic Thiophene Inhibitor (pdb 2hb1)






The binding sites of Bromine atom in the structure of Crystal Structure of PTP1B With Monocyclic Thiophene Inhibitor (pdb code 2hb1). This binding sites where shown with 5.0 Angstroms radius around Bromine atom.
The 2hb1 structure was solved by W.XU, Z.-K.WAN, J.LEE, with X-Ray Crystallography technique, brief refinement statistics is given in the table below:
Resolution (A)20.0-2.0
Space groupP3121
a (A)88.538
b (A)88.538
c (A)104.202
alpha (°)90.00
beta (°)90.00
gamma (°)120.00
Rfactor (%)21.8
Rfree (%)24.3


Bromine Binding Sites:

Bromine binding site 1 out of 1 in 2hb1


Bromine binding site 1 out of 1 in 2hb1
Click to enlarge
stereopicture of Bromine binding site 1 out of 1 in 2hb1
Click to enlarge
Mono- and Stereo- picture of 5.0 Angstrom coordination sphere 1 of Bromine in the PDB 2hb1. 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: Val49, A: Phe182, A: Ala217, A: Ile219, A: Gly220, A: Gln262, A: 512800, A: Hoh858,

conact list:


AtomAtomDistance (A)
BrCG2 A:Val494.32
BrCZ A:Phe1824.27
BrCE1 A:Phe1824.52
BrCB A:Ala2173.64
BrCD1 A:Ile2193.43
BrCG1 A:Ile2193.56
BrN A:Gly2204.93
BrNE2 A:Gln2624.30
BrOE1 A:Gln2623.62
BrCB A:Gln2624.91
BrCD A:Gln2623.63
BrCG A:Gln2623.68
BrC9 A:5128003.91
BrC1 A:5128002.89
BrO8 A:5128003.22
BrC2 A:5128001.88
BrBR19 A:5128000.00
BrC5 A:5128002.92
BrC4 A:5128004.16
BrS3 A:5128004.36
BrO A:Hoh8583.80

interactive model:




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