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Atomistry » Magnesium » PDB 4jty-4k5p » 4ju2 | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Atomistry » Magnesium » PDB 4jty-4k5p » 4ju2 » |
Magnesium in PDB 4ju2: Crystal Structure of Hcv NS5B Polymerase in Complex with Compound 12Enzymatic activity of Crystal Structure of Hcv NS5B Polymerase in Complex with Compound 12
All present enzymatic activity of Crystal Structure of Hcv NS5B Polymerase in Complex with Compound 12:
2.7.7.48; 3.4.21.98; 3.6.1.15; 3.6.4.13; Protein crystallography data
The structure of Crystal Structure of Hcv NS5B Polymerase in Complex with Compound 12, PDB code: 4ju2
was solved by
R.Coulombe,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Other elements in 4ju2:
The structure of Crystal Structure of Hcv NS5B Polymerase in Complex with Compound 12 also contains other interesting chemical elements:
Magnesium Binding Sites:
The binding sites of Magnesium atom in the Crystal Structure of Hcv NS5B Polymerase in Complex with Compound 12
(pdb code 4ju2). This binding sites where shown within
5.0 Angstroms radius around Magnesium atom.
In total 4 binding sites of Magnesium where determined in the Crystal Structure of Hcv NS5B Polymerase in Complex with Compound 12, PDB code: 4ju2: Jump to Magnesium binding site number: 1; 2; 3; 4; Magnesium binding site 1 out of 4 in 4ju2Go back to Magnesium Binding Sites List in 4ju2
Magnesium binding site 1 out
of 4 in the Crystal Structure of Hcv NS5B Polymerase in Complex with Compound 12
Mono view Stereo pair view
Magnesium binding site 2 out of 4 in 4ju2Go back to Magnesium Binding Sites List in 4ju2
Magnesium binding site 2 out
of 4 in the Crystal Structure of Hcv NS5B Polymerase in Complex with Compound 12
Mono view Stereo pair view
Magnesium binding site 3 out of 4 in 4ju2Go back to Magnesium Binding Sites List in 4ju2
Magnesium binding site 3 out
of 4 in the Crystal Structure of Hcv NS5B Polymerase in Complex with Compound 12
Mono view Stereo pair view
Magnesium binding site 4 out of 4 in 4ju2Go back to Magnesium Binding Sites List in 4ju2
Magnesium binding site 4 out
of 4 in the Crystal Structure of Hcv NS5B Polymerase in Complex with Compound 12
Mono view Stereo pair view
Reference:
O.Hucke,
R.Coulombe,
P.Bonneau,
M.Bertrand-Laperle,
C.Brochu,
J.Gillard,
M.A.Joly,
S.Landry,
O.Lepage,
M.Llinas-Brunet,
M.Pesant,
M.Poirier,
M.Poirier,
G.Mckercher,
M.Marquis,
G.Kukolj,
P.L.Beaulieu,
T.A.Stammers.
Molecular Dynamics Simulations and Structure-Based Rational Design Lead to Allosteric Hcv NS5B Polymerase Thumb Pocket 2 Inhibitor with Picomolar Cellular Replicon Potency. J.Med.Chem. V. 57 1932 2014.
Page generated: Mon Dec 14 19:01:01 2020
ISSN: ISSN 0022-2623 PubMed: 23773186 DOI: 10.1021/JM4004522 |
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