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Chlorine in PDB 5c37: Structure of the Beta-Ketoacyl Reductase Domain of Human Fatty Acid Synthase Bound to A Spiro-Imidazolone Inhibitor
Enzymatic activity of Structure of the Beta-Ketoacyl Reductase Domain of Human Fatty Acid Synthase Bound to A Spiro-Imidazolone Inhibitor
All present enzymatic activity of Structure of the Beta-Ketoacyl Reductase Domain of Human Fatty Acid Synthase Bound to A Spiro-Imidazolone Inhibitor:
1.1.1.100; 1.3.1.39; 2.3.1.38; 2.3.1.39; 2.3.1.41; 2.3.1.85; 4.2.1.59;
1.1.1.100; 1.3.1.39; 2.3.1.38; 2.3.1.39; 2.3.1.41; 2.3.1.85; 4.2.1.59;
Protein crystallography data
The structure of Structure of the Beta-Ketoacyl Reductase Domain of Human Fatty Acid Synthase Bound to A Spiro-Imidazolone Inhibitor, PDB code: 5c37
was solved by
C.Schubert,
C.M.Milligan,
K.Vo,
B.Grasberger,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 47.00 / 2.30 |
| Space group | P 1 21 1 |
| Cell size a, b, c (Å), α, β, γ (°) | 94.080, 80.520, 96.530, 90.00, 116.90, 90.00 |
| R / Rfree (%) | 21 / 25.1 |
Chlorine Binding Sites:
The binding sites of Chlorine atom in the Structure of the Beta-Ketoacyl Reductase Domain of Human Fatty Acid Synthase Bound to A Spiro-Imidazolone Inhibitor
(pdb code 5c37). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total 3 binding sites of Chlorine where determined in the Structure of the Beta-Ketoacyl Reductase Domain of Human Fatty Acid Synthase Bound to A Spiro-Imidazolone Inhibitor, PDB code: 5c37:
Jump to Chlorine binding site number: 1; 2; 3;
In total 3 binding sites of Chlorine where determined in the Structure of the Beta-Ketoacyl Reductase Domain of Human Fatty Acid Synthase Bound to A Spiro-Imidazolone Inhibitor, PDB code: 5c37:
Jump to Chlorine binding site number: 1; 2; 3;
Chlorine binding site 1 out of 3 in 5c37
Go back to
Chlorine Binding Sites List in 5c37
Chlorine binding site 1 out
of 3 in the Structure of the Beta-Ketoacyl Reductase Domain of Human Fatty Acid Synthase Bound to A Spiro-Imidazolone Inhibitor
Mono view
Stereo pair view
Mono view
Stereo pair view
A full contact list of Chlorine with other atoms in the Cl binding
site number 1 of Structure of the Beta-Ketoacyl Reductase Domain of Human Fatty Acid Synthase Bound to A Spiro-Imidazolone Inhibitor within 5.0Å range:
|
Chlorine binding site 2 out of 3 in 5c37
Go back to
Chlorine Binding Sites List in 5c37
Chlorine binding site 2 out
of 3 in the Structure of the Beta-Ketoacyl Reductase Domain of Human Fatty Acid Synthase Bound to A Spiro-Imidazolone Inhibitor
Mono view
Stereo pair view
Mono view
Stereo pair view
A full contact list of Chlorine with other atoms in the Cl binding
site number 2 of Structure of the Beta-Ketoacyl Reductase Domain of Human Fatty Acid Synthase Bound to A Spiro-Imidazolone Inhibitor within 5.0Å range:
|
Chlorine binding site 3 out of 3 in 5c37
Go back to
Chlorine Binding Sites List in 5c37
Chlorine binding site 3 out
of 3 in the Structure of the Beta-Ketoacyl Reductase Domain of Human Fatty Acid Synthase Bound to A Spiro-Imidazolone Inhibitor
Mono view
Stereo pair view
Mono view
Stereo pair view
A full contact list of Chlorine with other atoms in the Cl binding
site number 3 of Structure of the Beta-Ketoacyl Reductase Domain of Human Fatty Acid Synthase Bound to A Spiro-Imidazolone Inhibitor within 5.0Å range:
|
Reference:
T.Lu,
C.Schubert,
M.D.Cummings,
G.Bignan,
P.Connolly,
K.Smans,
D.Ludovici,
M.Parker,
C.Meyer,
C.Rocaboy,
R.Alexander,
B.Grasberger,
S.De Breucker,
N.Esser,
E.Fraiponts,
R.Gilissen,
B.Janssens,
D.Peeters,
L.Van Nuffel,
P.Vermeulen,
J.Bischoff,
L.Meerpoel.
Design and Synthesis of A Series of Bioavailable Fatty Acid Synthase (Fasn) Kr Domain Inhibitors For Cancer Therapy To Be Published.
Page generated: Sat Dec 12 11:34:21 2020
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