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Chlorine in PDB 4bda: Fragment-Based Screening Identifies A New Area For Inhibitor Binding to Checkpoint Kinase 2 (CHK2)
Enzymatic activity of Fragment-Based Screening Identifies A New Area For Inhibitor Binding to Checkpoint Kinase 2 (CHK2)
All present enzymatic activity of Fragment-Based Screening Identifies A New Area For Inhibitor Binding to Checkpoint Kinase 2 (CHK2):
2.7.11.1;
2.7.11.1;
Protein crystallography data
The structure of Fragment-Based Screening Identifies A New Area For Inhibitor Binding to Checkpoint Kinase 2 (CHK2), PDB code: 4bda
was solved by
M.C.Silva-Santisteban,
I.M.Westwood,
K.Boxall,
N.Brown,
S.Peacock,
C.Mcandrew,
E.Barrie,
M.Richards,
A.Mirza,
A.W.Oliver,
R.Burke,
S.Hoelder,
K.Jones,
G.W.Aherne,
J.Blagg,
I.Collins,
M.D.Garrett,
R.L.M.Van Montfort,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 22.68 / 2.60 |
| Space group | P 32 2 1 |
| Cell size a, b, c (Å), α, β, γ (°) | 91.130, 91.130, 93.110, 90.00, 90.00, 120.00 |
| R / Rfree (%) | 18.04 / 23.65 |
Chlorine Binding Sites:
The binding sites of Chlorine atom in the Fragment-Based Screening Identifies A New Area For Inhibitor Binding to Checkpoint Kinase 2 (CHK2)
(pdb code 4bda). 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 Fragment-Based Screening Identifies A New Area For Inhibitor Binding to Checkpoint Kinase 2 (CHK2), PDB code: 4bda:
In total only one binding site of Chlorine was determined in the Fragment-Based Screening Identifies A New Area For Inhibitor Binding to Checkpoint Kinase 2 (CHK2), PDB code: 4bda:
Chlorine binding site 1 out of 1 in 4bda
Go back to
Chlorine Binding Sites List in 4bda
Chlorine binding site 1 out
of 1 in the Fragment-Based Screening Identifies A New Area For Inhibitor Binding to Checkpoint Kinase 2 (CHK2)
Mono view
Stereo pair view
Mono view
Stereo pair view
A full contact list of Chlorine with other atoms in the Cl binding
site number 1 of Fragment-Based Screening Identifies A New Area For Inhibitor Binding to Checkpoint Kinase 2 (CHK2) within 5.0Å range:
|
Reference:
M.C.Silva-Santisteban,
I.M.Westwood,
K.Boxall,
N.Brown,
S.Peacock,
C.Mcandrew,
E.Barrie,
M.Richards,
A.Mirza,
A.W.Oliver,
R.Burke,
S.Hoelder,
K.Jones,
G.W.Aherne,
J.Blagg,
I.Collins,
M.D.Garrett,
R.L.Van Montfort.
Fragment-Based Screening Maps Inhibitor Interactions in the Atp-Binding Site of Checkpoint Kinase 2. Plos One V. 8 65689 2013.
ISSN: ISSN 1932-6203
PubMed: 23776527
DOI: 10.1371/JOURNAL.PONE.0065689
Page generated: Sun Jul 21 10:00:01 2024
ISSN: ISSN 1932-6203
PubMed: 23776527
DOI: 10.1371/JOURNAL.PONE.0065689
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