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Fluorine in PDB 4zg9: Structural Basis For Inhibition of Human Autotaxin By Four Novel Compounds
Enzymatic activity of Structural Basis For Inhibition of Human Autotaxin By Four Novel Compounds
All present enzymatic activity of Structural Basis For Inhibition of Human Autotaxin By Four Novel Compounds:
3.1.4.39;
3.1.4.39;
Protein crystallography data
The structure of Structural Basis For Inhibition of Human Autotaxin By Four Novel Compounds, PDB code: 4zg9
was solved by
A.J.Stein,
G.Bain,
J.H.Hutchinson,
J.F.Evans,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 43.86 / 2.95 |
| Space group | C 2 2 21 |
| Cell size a, b, c (Å), α, β, γ (°) | 127.460, 209.991, 188.193, 90.00, 90.00, 90.00 |
| R / Rfree (%) | 17.9 / 24.4 |
Other elements in 4zg9:
The structure of Structural Basis For Inhibition of Human Autotaxin By Four Novel Compounds also contains other interesting chemical elements:
| Zinc | (Zn) | 4 atoms |
| Calcium | (Ca) | 2 atoms |
| Sodium | (Na) | 4 atoms |
Fluorine Binding Sites:
The binding sites of Fluorine atom in the Structural Basis For Inhibition of Human Autotaxin By Four Novel Compounds
(pdb code 4zg9). This binding sites where shown within
5.0 Angstroms radius around Fluorine atom.
In total 4 binding sites of Fluorine where determined in the Structural Basis For Inhibition of Human Autotaxin By Four Novel Compounds, PDB code: 4zg9:
Jump to Fluorine binding site number: 1; 2; 3; 4;
In total 4 binding sites of Fluorine where determined in the Structural Basis For Inhibition of Human Autotaxin By Four Novel Compounds, PDB code: 4zg9:
Jump to Fluorine binding site number: 1; 2; 3; 4;
Fluorine binding site 1 out of 4 in 4zg9
Go back to
Fluorine Binding Sites List in 4zg9
Fluorine binding site 1 out
of 4 in the Structural Basis For Inhibition of Human Autotaxin By Four Novel Compounds
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 Structural Basis For Inhibition of Human Autotaxin By Four Novel Compounds within 5.0Å range:
|
Fluorine binding site 2 out of 4 in 4zg9
Go back to
Fluorine Binding Sites List in 4zg9
Fluorine binding site 2 out
of 4 in the Structural Basis For Inhibition of Human Autotaxin By Four Novel Compounds
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 Structural Basis For Inhibition of Human Autotaxin By Four Novel Compounds within 5.0Å range:
|
Fluorine binding site 3 out of 4 in 4zg9
Go back to
Fluorine Binding Sites List in 4zg9
Fluorine binding site 3 out
of 4 in the Structural Basis For Inhibition of Human Autotaxin By Four Novel Compounds
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 Structural Basis For Inhibition of Human Autotaxin By Four Novel Compounds within 5.0Å range:
|
Fluorine binding site 4 out of 4 in 4zg9
Go back to
Fluorine Binding Sites List in 4zg9
Fluorine binding site 4 out
of 4 in the Structural Basis For Inhibition of Human Autotaxin By Four Novel Compounds
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 Structural Basis For Inhibition of Human Autotaxin By Four Novel Compounds within 5.0Å range:
|
Reference:
A.J.Stein,
G.Bain,
P.Prodanovich,
A.M.Santini,
J.Darlington,
N.M.Stelzer,
R.S.Sidhu,
J.Schaub,
L.Goulet,
D.Lonergan,
I.Calderon,
J.F.Evans,
J.H.Hutchinson.
Structural Basis For Inhibition of Human Autotaxin By Four Potent Compounds with Distinct Modes of Binding. Mol.Pharmacol. V. 88 982 2015.
ISSN: ESSN 1521-0111
PubMed: 26371182
DOI: 10.1124/MOL.115.100404
Page generated: Thu Aug 1 07:14:22 2024
ISSN: ESSN 1521-0111
PubMed: 26371182
DOI: 10.1124/MOL.115.100404
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