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Sodium in PDB 4e1e: Crystal Structure of Trypanosome Cruzi Farnesyl Diphosphate Synthase in Complex with [2-(N-Hexylamino)Ethane-1,1-Diyl]Bisphosphonic Acid and MG2+
Enzymatic activity of Crystal Structure of Trypanosome Cruzi Farnesyl Diphosphate Synthase in Complex with [2-(N-Hexylamino)Ethane-1,1-Diyl]Bisphosphonic Acid and MG2+
All present enzymatic activity of Crystal Structure of Trypanosome Cruzi Farnesyl Diphosphate Synthase in Complex with [2-(N-Hexylamino)Ethane-1,1-Diyl]Bisphosphonic Acid and MG2+:
2.5.1.10;
2.5.1.10;
Protein crystallography data
The structure of Crystal Structure of Trypanosome Cruzi Farnesyl Diphosphate Synthase in Complex with [2-(N-Hexylamino)Ethane-1,1-Diyl]Bisphosphonic Acid and MG2+, PDB code: 4e1e
was solved by
S.Aripirala,
L.M.Amzel,
S.B.Gabelli,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 28.97 / 2.65 |
| Space group | P 61 2 2 |
| Cell size a, b, c (Å), α, β, γ (°) | 58.575, 58.575, 393.933, 90.00, 90.00, 120.00 |
| R / Rfree (%) | 23.2 / 30.8 |
Other elements in 4e1e:
The structure of Crystal Structure of Trypanosome Cruzi Farnesyl Diphosphate Synthase in Complex with [2-(N-Hexylamino)Ethane-1,1-Diyl]Bisphosphonic Acid and MG2+ also contains other interesting chemical elements:
| Magnesium | (Mg) | 3 atoms |
Sodium Binding Sites:
The binding sites of Sodium atom in the Crystal Structure of Trypanosome Cruzi Farnesyl Diphosphate Synthase in Complex with [2-(N-Hexylamino)Ethane-1,1-Diyl]Bisphosphonic Acid and MG2+
(pdb code 4e1e). This binding sites where shown within
5.0 Angstroms radius around Sodium atom.
In total only one binding site of Sodium was determined in the Crystal Structure of Trypanosome Cruzi Farnesyl Diphosphate Synthase in Complex with [2-(N-Hexylamino)Ethane-1,1-Diyl]Bisphosphonic Acid and MG2+, PDB code: 4e1e:
In total only one binding site of Sodium was determined in the Crystal Structure of Trypanosome Cruzi Farnesyl Diphosphate Synthase in Complex with [2-(N-Hexylamino)Ethane-1,1-Diyl]Bisphosphonic Acid and MG2+, PDB code: 4e1e:
Sodium binding site 1 out of 1 in 4e1e
Go back to
Sodium Binding Sites List in 4e1e
Sodium binding site 1 out
of 1 in the Crystal Structure of Trypanosome Cruzi Farnesyl Diphosphate Synthase in Complex with [2-(N-Hexylamino)Ethane-1,1-Diyl]Bisphosphonic Acid and MG2+
Mono view
Stereo pair view
Mono view
Stereo pair view
A full contact list of Sodium with other atoms in the Na binding
site number 1 of Crystal Structure of Trypanosome Cruzi Farnesyl Diphosphate Synthase in Complex with [2-(N-Hexylamino)Ethane-1,1-Diyl]Bisphosphonic Acid and MG2+ within 5.0Å range:
|
Reference:
S.Aripirala,
S.H.Szajnman,
J.Jakoncic,
J.B.Rodriguez,
R.Docampo,
S.B.Gabelli,
L.M.Amzel.
Design, Synthesis, Calorimetry, and Crystallographic Analysis of 2-Alkylaminoethyl-1,1-Bisphosphonates As Inhibitors of Trypanosoma Cruzi Farnesyl Diphosphate Synthase. J.Med.Chem. V. 55 6445 2012.
ISSN: ISSN 0022-2623
PubMed: 22715997
DOI: 10.1021/JM300425Y
Page generated: Mon Oct 7 15:05:39 2024
ISSN: ISSN 0022-2623
PubMed: 22715997
DOI: 10.1021/JM300425Y
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