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Fluorine in PDB 6rse: Structure Based Optimization of JAK1-Atp Binding Pocket Inhibitors in the Aminopyrazole Class
Enzymatic activity of Structure Based Optimization of JAK1-Atp Binding Pocket Inhibitors in the Aminopyrazole Class
All present enzymatic activity of Structure Based Optimization of JAK1-Atp Binding Pocket Inhibitors in the Aminopyrazole Class:
2.7.10.2;
2.7.10.2;
Protein crystallography data
The structure of Structure Based Optimization of JAK1-Atp Binding Pocket Inhibitors in the Aminopyrazole Class, PDB code: 6rse
was solved by
D.G.Brown,
P.J.Lupardus,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 39.04 / 1.80 |
| Space group | P 21 21 21 |
| Cell size a, b, c (Å), α, β, γ (°) | 42.890, 88.960, 173.810, 90.00, 90.00, 90.00 |
| R / Rfree (%) | 26.3 / 30.4 |
Fluorine Binding Sites:
The binding sites of Fluorine atom in the Structure Based Optimization of JAK1-Atp Binding Pocket Inhibitors in the Aminopyrazole Class
(pdb code 6rse). This binding sites where shown within
5.0 Angstroms radius around Fluorine atom.
In total 4 binding sites of Fluorine where determined in the Structure Based Optimization of JAK1-Atp Binding Pocket Inhibitors in the Aminopyrazole Class, PDB code: 6rse:
Jump to Fluorine binding site number: 1; 2; 3; 4;
In total 4 binding sites of Fluorine where determined in the Structure Based Optimization of JAK1-Atp Binding Pocket Inhibitors in the Aminopyrazole Class, PDB code: 6rse:
Jump to Fluorine binding site number: 1; 2; 3; 4;
Fluorine binding site 1 out of 4 in 6rse
Go back to
Fluorine Binding Sites List in 6rse
Fluorine binding site 1 out
of 4 in the Structure Based Optimization of JAK1-Atp Binding Pocket Inhibitors in the Aminopyrazole Class
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 Based Optimization of JAK1-Atp Binding Pocket Inhibitors in the Aminopyrazole Class within 5.0Å range:
|
Fluorine binding site 2 out of 4 in 6rse
Go back to
Fluorine Binding Sites List in 6rse
Fluorine binding site 2 out
of 4 in the Structure Based Optimization of JAK1-Atp Binding Pocket Inhibitors in the Aminopyrazole Class
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 2 of Structure Based Optimization of JAK1-Atp Binding Pocket Inhibitors in the Aminopyrazole Class within 5.0Å range:
|
Fluorine binding site 3 out of 4 in 6rse
Go back to
Fluorine Binding Sites List in 6rse
Fluorine binding site 3 out
of 4 in the Structure Based Optimization of JAK1-Atp Binding Pocket Inhibitors in the Aminopyrazole Class
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 3 of Structure Based Optimization of JAK1-Atp Binding Pocket Inhibitors in the Aminopyrazole Class within 5.0Å range:
|
Fluorine binding site 4 out of 4 in 6rse
Go back to
Fluorine Binding Sites List in 6rse
Fluorine binding site 4 out
of 4 in the Structure Based Optimization of JAK1-Atp Binding Pocket Inhibitors in the Aminopyrazole Class
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 4 of Structure Based Optimization of JAK1-Atp Binding Pocket Inhibitors in the Aminopyrazole Class within 5.0Å range:
|
Reference:
M.Zak,
P.Gibbons,
D.G.Brown.
Structure Based Optimization of JAK1-Atp Binding Pocket Inhibitors in the Aminopyrazole Class To Be Published.
Page generated: Fri Aug 2 01:22:14 2024
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