Atomistry » Chlorine » PDB 3d4i-3dgo » 3dbd
Atomistry »
  Chlorine »
    PDB 3d4i-3dgo »
      3dbd »

Chlorine in PDB 3dbd: Crystal Structure of An Activated (Thr->Asp) Polo-Like Kinase 1 (PLK1) Catalytic Domain in Complex with Compound 094

Enzymatic activity of Crystal Structure of An Activated (Thr->Asp) Polo-Like Kinase 1 (PLK1) Catalytic Domain in Complex with Compound 094

All present enzymatic activity of Crystal Structure of An Activated (Thr->Asp) Polo-Like Kinase 1 (PLK1) Catalytic Domain in Complex with Compound 094:
2.7.11.21;

Protein crystallography data

The structure of Crystal Structure of An Activated (Thr->Asp) Polo-Like Kinase 1 (PLK1) Catalytic Domain in Complex with Compound 094, PDB code: 3dbd was solved by R.A.Elling, K.J.Barr, M.J.Romanowski, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 30.00 / 3.05
Space group I 2 3
Cell size a, b, c (Å), α, β, γ (°) 135.267, 135.267, 135.267, 90.00, 90.00, 90.00
R / Rfree (%) 25 / 27.6

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Crystal Structure of An Activated (Thr->Asp) Polo-Like Kinase 1 (PLK1) Catalytic Domain in Complex with Compound 094 (pdb code 3dbd). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total only one binding site of Chlorine was determined in the Crystal Structure of An Activated (Thr->Asp) Polo-Like Kinase 1 (PLK1) Catalytic Domain in Complex with Compound 094, PDB code: 3dbd:

Chlorine binding site 1 out of 1 in 3dbd

Go back to Chlorine Binding Sites List in 3dbd
Chlorine binding site 1 out of 1 in the Crystal Structure of An Activated (Thr->Asp) Polo-Like Kinase 1 (PLK1) Catalytic Domain in Complex with Compound 094


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Crystal Structure of An Activated (Thr->Asp) Polo-Like Kinase 1 (PLK1) Catalytic Domain in Complex with Compound 094 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl313

b:50.5
occ:1.00
 CL A:3FR313 0.0 50.5 1.0
C20 A:3FR313 1.8 50.6 1.0
C21 A:3FR313 2.8 50.5 1.0
C19 A:3FR313 2.8 50.5 1.0
N A:GLY48 3.7 63.9 1.0
CB A:CYS53 3.8 62.5 1.0
CB A:ALA51 3.8 68.3 1.0
CE A:LYS68 3.9 62.2 1.0
O A:ALA51 3.9 67.8 1.0
N A:CYS53 3.9 63.3 1.0
C A:ALA51 4.0 67.6 1.0
C22 A:3FR313 4.1 50.5 1.0
CG A:LYS68 4.1 62.1 1.0
C18 A:3FR313 4.1 50.3 1.0
CA A:GLY48 4.1 65.1 1.0
C A:LYS52 4.2 64.5 1.0
N A:LYS52 4.3 66.6 1.0
C A:LYS47 4.3 63.0 1.0
CA A:CYS53 4.3 62.5 1.0
CD A:LYS68 4.3 62.1 1.0
CA A:LYS52 4.4 65.8 1.0
CA A:ALA51 4.6 68.3 1.0
C23 A:3FR313 4.6 50.4 1.0
CA A:LYS47 4.6 62.1 1.0
O A:GLY46 4.7 59.3 1.0
NZ A:LYS68 4.7 62.3 1.0
O A:LYS52 4.9 64.5 1.0
SG A:CYS53 4.9 62.8 1.0

Reference:

R.V.Fucini, E.J.Hanan, M.J.Romanowski, R.A.Elling, W.Lew, K.J.Barr, J.Zhu, J.C.Yoburn, Y.Liu, B.T.Fahr, J.Fan, Y.Lu, P.Pham, I.C.Choong, E.C.Vanderporten, M.Bui, H.E.Purkey, M.J.Evanchik, W.Yang. Design and Synthesis of 2-Amino-Pyrazolopyridines As Polo-Like Kinase 1 Inhibitors. Bioorg.Med.Chem.Lett. V. 18 5648 2008.
ISSN: ISSN 0960-894X
PubMed: 18793847
DOI: 10.1016/J.BMCL.2008.08.095
Page generated: Fri Jul 11 04:24:29 2025

Last articles

Cl in 3R3U
Cl in 3R33
Cl in 3R3Q
Cl in 3R3K
Cl in 3R38
Cl in 3R2J
Cl in 3R2U
Cl in 3R28
Cl in 3R1Q
Cl in 3R20
© Copyright 2008-2020 by atomistry.com
Home   |    Site Map   |    Copyright   |    Contact us   |    Privacy