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Fluorine in PDB 4xja: Crystal Structure of the Nanb Sialidase From Streptococcus Pneumoniae in Complex with 5-Acetamido-2,3-Difluoro-3-Hydroxy-6-[1,2,3- Trihydroxypropyl]Oxane-2-Carboxylic Acid
Enzymatic activity of Crystal Structure of the Nanb Sialidase From Streptococcus Pneumoniae in Complex with 5-Acetamido-2,3-Difluoro-3-Hydroxy-6-[1,2,3- Trihydroxypropyl]Oxane-2-Carboxylic Acid
All present enzymatic activity of Crystal Structure of the Nanb Sialidase From Streptococcus Pneumoniae in Complex with 5-Acetamido-2,3-Difluoro-3-Hydroxy-6-[1,2,3- Trihydroxypropyl]Oxane-2-Carboxylic Acid:
3.2.1.18;
3.2.1.18;
Protein crystallography data
The structure of Crystal Structure of the Nanb Sialidase From Streptococcus Pneumoniae in Complex with 5-Acetamido-2,3-Difluoro-3-Hydroxy-6-[1,2,3- Trihydroxypropyl]Oxane-2-Carboxylic Acid, PDB code: 4xja
was solved by
P.Brear,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 20.00 / 1.98 |
| Space group | P 21 21 21 |
| Cell size a, b, c (Å), α, β, γ (°) | 76.586, 82.556, 116.654, 90.00, 90.00, 90.00 |
| R / Rfree (%) | 16.7 / 20.1 |
Fluorine Binding Sites:
The binding sites of Fluorine atom in the Crystal Structure of the Nanb Sialidase From Streptococcus Pneumoniae in Complex with 5-Acetamido-2,3-Difluoro-3-Hydroxy-6-[1,2,3- Trihydroxypropyl]Oxane-2-Carboxylic Acid
(pdb code 4xja). This binding sites where shown within
5.0 Angstroms radius around Fluorine atom.
In total 2 binding sites of Fluorine where determined in the Crystal Structure of the Nanb Sialidase From Streptococcus Pneumoniae in Complex with 5-Acetamido-2,3-Difluoro-3-Hydroxy-6-[1,2,3- Trihydroxypropyl]Oxane-2-Carboxylic Acid, PDB code: 4xja:
Jump to Fluorine binding site number: 1; 2;
In total 2 binding sites of Fluorine where determined in the Crystal Structure of the Nanb Sialidase From Streptococcus Pneumoniae in Complex with 5-Acetamido-2,3-Difluoro-3-Hydroxy-6-[1,2,3- Trihydroxypropyl]Oxane-2-Carboxylic Acid, PDB code: 4xja:
Jump to Fluorine binding site number: 1; 2;
Fluorine binding site 1 out of 2 in 4xja
Go back to
Fluorine Binding Sites List in 4xja
Fluorine binding site 1 out
of 2 in the Crystal Structure of the Nanb Sialidase From Streptococcus Pneumoniae in Complex with 5-Acetamido-2,3-Difluoro-3-Hydroxy-6-[1,2,3- Trihydroxypropyl]Oxane-2-Carboxylic Acid
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 Crystal Structure of the Nanb Sialidase From Streptococcus Pneumoniae in Complex with 5-Acetamido-2,3-Difluoro-3-Hydroxy-6-[1,2,3- Trihydroxypropyl]Oxane-2-Carboxylic Acid within 5.0Å range:
|
Fluorine binding site 2 out of 2 in 4xja
Go back to
Fluorine Binding Sites List in 4xja
Fluorine binding site 2 out
of 2 in the Crystal Structure of the Nanb Sialidase From Streptococcus Pneumoniae in Complex with 5-Acetamido-2,3-Difluoro-3-Hydroxy-6-[1,2,3- Trihydroxypropyl]Oxane-2-Carboxylic Acid
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 Crystal Structure of the Nanb Sialidase From Streptococcus Pneumoniae in Complex with 5-Acetamido-2,3-Difluoro-3-Hydroxy-6-[1,2,3- Trihydroxypropyl]Oxane-2-Carboxylic Acid within 5.0Å range:
|
Reference:
G.W.Rogers,
P.Brear,
L.Yang,
A.S.Chen,
J.B.O.Mitchell,
G.L.Taylor,
N.J.Westwood.
`the Hunt For Serendipitous Allosteric Sites: Discovery of A Novel Allosteric Inhibitor of the Bacterial Sialidase Nanb To Be Published.
Page generated: Sun Dec 13 12:15:02 2020
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