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Fluorine in PDB 2iqg: Crystal Structure of Hydroxyethyl Secondary Amine-Based Peptidomimetic Inhibitor of Human Beta-Secretase (Bace)
Enzymatic activity of Crystal Structure of Hydroxyethyl Secondary Amine-Based Peptidomimetic Inhibitor of Human Beta-Secretase (Bace)
All present enzymatic activity of Crystal Structure of Hydroxyethyl Secondary Amine-Based Peptidomimetic Inhibitor of Human Beta-Secretase (Bace):
3.4.23.46;
3.4.23.46;
Protein crystallography data
The structure of Crystal Structure of Hydroxyethyl Secondary Amine-Based Peptidomimetic Inhibitor of Human Beta-Secretase (Bace), PDB code: 2iqg
was solved by
T.E.Benson,
D.D.Woods,
D.B.Prince,
A.G.Tomasselli,
T.L.Emmons,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 20.00 / 1.70 |
| Space group | C 1 2 1 |
| Cell size a, b, c (Å), α, β, γ (°) | 73.090, 105.080, 50.500, 90.00, 94.81, 90.00 |
| R / Rfree (%) | 20.6 / 23.1 |
Other elements in 2iqg:
The structure of Crystal Structure of Hydroxyethyl Secondary Amine-Based Peptidomimetic Inhibitor of Human Beta-Secretase (Bace) also contains other interesting chemical elements:
| Iodine | (I) | 1 atom |
Fluorine Binding Sites:
The binding sites of Fluorine atom in the Crystal Structure of Hydroxyethyl Secondary Amine-Based Peptidomimetic Inhibitor of Human Beta-Secretase (Bace)
(pdb code 2iqg). 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 Hydroxyethyl Secondary Amine-Based Peptidomimetic Inhibitor of Human Beta-Secretase (Bace), PDB code: 2iqg:
Jump to Fluorine binding site number: 1; 2;
In total 2 binding sites of Fluorine where determined in the Crystal Structure of Hydroxyethyl Secondary Amine-Based Peptidomimetic Inhibitor of Human Beta-Secretase (Bace), PDB code: 2iqg:
Jump to Fluorine binding site number: 1; 2;
Fluorine binding site 1 out of 2 in 2iqg
Go back to
Fluorine Binding Sites List in 2iqg
Fluorine binding site 1 out
of 2 in the Crystal Structure of Hydroxyethyl Secondary Amine-Based Peptidomimetic Inhibitor of Human Beta-Secretase (Bace)
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 Hydroxyethyl Secondary Amine-Based Peptidomimetic Inhibitor of Human Beta-Secretase (Bace) within 5.0Å range:
|
Fluorine binding site 2 out of 2 in 2iqg
Go back to
Fluorine Binding Sites List in 2iqg
Fluorine binding site 2 out
of 2 in the Crystal Structure of Hydroxyethyl Secondary Amine-Based Peptidomimetic Inhibitor of Human Beta-Secretase (Bace)
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 Hydroxyethyl Secondary Amine-Based Peptidomimetic Inhibitor of Human Beta-Secretase (Bace) within 5.0Å range:
|
Reference:
M.C.Maillard,
R.K.Hom,
T.E.Benson,
J.B.Moon,
S.Mamo,
M.Bienkowski,
A.G.Tomasselli,
D.D.Woods,
D.B.Prince,
D.J.Paddock,
T.L.Emmons,
J.A.Tucker,
M.S.Dappen,
L.Brogley,
E.D.Thorsett,
N.Jewett,
S.Sinha,
V.John.
Design, Synthesis, and Crystal Structure of Hydroxyethyl Secondary Amine-Based Peptidomimetic Inhibitors of Human Beta-Secretase. J.Med.Chem. V. 50 776 2007.
ISSN: ISSN 0022-2623
PubMed: 17300163
DOI: 10.1021/JM061242Y
Page generated: Wed Jul 31 14:55:28 2024
ISSN: ISSN 0022-2623
PubMed: 17300163
DOI: 10.1021/JM061242Y
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