Fluorine in PDB 6haw: Crystal Structure of Bovine Cytochrome BC1 in Complex with 2-Pyrazolyl Quinolone Inhibitor WDH2G7
Enzymatic activity of Crystal Structure of Bovine Cytochrome BC1 in Complex with 2-Pyrazolyl Quinolone Inhibitor WDH2G7
All present enzymatic activity of Crystal Structure of Bovine Cytochrome BC1 in Complex with 2-Pyrazolyl Quinolone Inhibitor WDH2G7:
1.10.2.2;
1.10.2.2;
Protein crystallography data
The structure of Crystal Structure of Bovine Cytochrome BC1 in Complex with 2-Pyrazolyl Quinolone Inhibitor WDH2G7, PDB code: 6haw
was solved by
K.Amporndanai,
W.D.Hong,
P.M.O'neill,
S.S.Hasnain,
S.V.Antonyuk,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 92.10 / 3.45 |
| Space group | P 65 2 2 |
| Cell size a, b, c (Å), α, β, γ (°) | 212.690, 212.690, 347.066, 90.00, 90.00, 120.00 |
| R / Rfree (%) | 21 / 24.2 |
Other elements in 6haw:
The structure of Crystal Structure of Bovine Cytochrome BC1 in Complex with 2-Pyrazolyl Quinolone Inhibitor WDH2G7 also contains other interesting chemical elements:
| Iron | (Fe) | 5 atoms |
Fluorine Binding Sites:
The binding sites of Fluorine atom in the Crystal Structure of Bovine Cytochrome BC1 in Complex with 2-Pyrazolyl Quinolone Inhibitor WDH2G7
(pdb code 6haw). This binding sites where shown within
5.0 Angstroms radius around Fluorine atom.
In total 3 binding sites of Fluorine where determined in the Crystal Structure of Bovine Cytochrome BC1 in Complex with 2-Pyrazolyl Quinolone Inhibitor WDH2G7, PDB code: 6haw:
Jump to Fluorine binding site number: 1; 2; 3;
In total 3 binding sites of Fluorine where determined in the Crystal Structure of Bovine Cytochrome BC1 in Complex with 2-Pyrazolyl Quinolone Inhibitor WDH2G7, PDB code: 6haw:
Jump to Fluorine binding site number: 1; 2; 3;
Fluorine binding site 1 out of 3 in 6haw
Go back to
Fluorine Binding Sites List in 6haw
Fluorine binding site 1 out
of 3 in the Crystal Structure of Bovine Cytochrome BC1 in Complex with 2-Pyrazolyl Quinolone Inhibitor WDH2G7
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 Bovine Cytochrome BC1 in Complex with 2-Pyrazolyl Quinolone Inhibitor WDH2G7 within 5.0Å range:
|
Fluorine binding site 2 out of 3 in 6haw
Go back to
Fluorine Binding Sites List in 6haw
Fluorine binding site 2 out
of 3 in the Crystal Structure of Bovine Cytochrome BC1 in Complex with 2-Pyrazolyl Quinolone Inhibitor WDH2G7
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 Bovine Cytochrome BC1 in Complex with 2-Pyrazolyl Quinolone Inhibitor WDH2G7 within 5.0Å range:
|
Fluorine binding site 3 out of 3 in 6haw
Go back to
Fluorine Binding Sites List in 6haw
Fluorine binding site 3 out
of 3 in the Crystal Structure of Bovine Cytochrome BC1 in Complex with 2-Pyrazolyl Quinolone Inhibitor WDH2G7
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 3 of Crystal Structure of Bovine Cytochrome BC1 in Complex with 2-Pyrazolyl Quinolone Inhibitor WDH2G7 within 5.0Å range:
|
Reference:
W.David Hong,
S.C.Leung,
K.Amporndanai,
J.Davies,
R.S.Priestley,
G.L.Nixon,
N.G.Berry,
S.Samar Hasnain,
S.Antonyuk,
S.A.Ward,
G.A.Biagini,
P.M.O'neill.
Potent Antimalarial 2-Pyrazolyl QUINOLONEBC1(Qi) Inhibitors with Improved Drug-Like Properties. Acs Med Chem Lett V. 9 1205 2018.
ISSN: ISSN 1948-5875
PubMed: 30613327
DOI: 10.1021/ACSMEDCHEMLETT.8B00371
Page generated: Sun Dec 13 12:52:28 2020
ISSN: ISSN 1948-5875
PubMed: 30613327
DOI: 10.1021/ACSMEDCHEMLETT.8B00371
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