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Fluorine in PDB 3iw8: Structure of Inactive Human P38 Map Kinase in Complex with A Thiazole-Urea
Enzymatic activity of Structure of Inactive Human P38 Map Kinase in Complex with A Thiazole-Urea
All present enzymatic activity of Structure of Inactive Human P38 Map Kinase in Complex with A Thiazole-Urea:
2.7.11.24;
2.7.11.24;
Protein crystallography data
The structure of Structure of Inactive Human P38 Map Kinase in Complex with A Thiazole-Urea, PDB code: 3iw8
was solved by
C.Gruetter,
J.R.Simard,
D.Rauh,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 40.00 / 2.00 |
| Space group | P 21 21 21 |
| Cell size a, b, c (Å), α, β, γ (°) | 68.370, 69.840, 74.700, 90.00, 90.00, 90.00 |
| R / Rfree (%) | 21.7 / 29.8 |
Other elements in 3iw8:
The structure of Structure of Inactive Human P38 Map Kinase in Complex with A Thiazole-Urea also contains other interesting chemical elements:
| Chlorine | (Cl) | 1 atom |
Fluorine Binding Sites:
The binding sites of Fluorine atom in the Structure of Inactive Human P38 Map Kinase in Complex with A Thiazole-Urea
(pdb code 3iw8). This binding sites where shown within
5.0 Angstroms radius around Fluorine atom.
In total only one binding site of Fluorine was determined in the Structure of Inactive Human P38 Map Kinase in Complex with A Thiazole-Urea, PDB code: 3iw8:
In total only one binding site of Fluorine was determined in the Structure of Inactive Human P38 Map Kinase in Complex with A Thiazole-Urea, PDB code: 3iw8:
Fluorine binding site 1 out of 1 in 3iw8
Go back to
Fluorine Binding Sites List in 3iw8
Fluorine binding site 1 out
of 1 in the Structure of Inactive Human P38 Map Kinase in Complex with A Thiazole-Urea
Mono view
Stereo pair view
Mono view
Stereo pair view
A full contact list of Fluorine with other atoms in the F binding
site number 1 of Structure of Inactive Human P38 Map Kinase in Complex with A Thiazole-Urea within 5.0Å range:
|
Reference:
J.R.Simard,
C.Gruetter,
V.Pawar,
B.Aust,
A.Wolf,
M.Rabiller,
S.Wulfert,
A.Robubi,
S.Kluter,
C.Ottmann,
D.Rauh.
High-Throughput Screening to Identify Inhibitors Which Stabilize Inactive Kinase Conformations in P38ALPHA J.Am.Chem.Soc. V. 131 18478 2009.
ISSN: ISSN 0002-7863
PubMed: 19950957
DOI: 10.1021/JA907795Q
Page generated: Mon Jul 14 17:06:44 2025
ISSN: ISSN 0002-7863
PubMed: 19950957
DOI: 10.1021/JA907795Q
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