Fluorine in PDB 6lp6: Crystal Structure of Human Dhodh in Complex with Inhibitor 1214
Enzymatic activity of Crystal Structure of Human Dhodh in Complex with Inhibitor 1214
All present enzymatic activity of Crystal Structure of Human Dhodh in Complex with Inhibitor 1214:
1.3.5.2;
1.3.5.2;
Protein crystallography data
The structure of Crystal Structure of Human Dhodh in Complex with Inhibitor 1214, PDB code: 6lp6
was solved by
Q.Chen,
Y.Yu,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 37.38 / 1.80 |
| Space group | P 32 2 1 |
| Cell size a, b, c (Å), α, β, γ (°) | 90.605, 90.605, 123.057, 90.00, 90.00, 120.00 |
| R / Rfree (%) | 15.5 / 17.8 |
Other elements in 6lp6:
The structure of Crystal Structure of Human Dhodh in Complex with Inhibitor 1214 also contains other interesting chemical elements:
| Sodium | (Na) | 3 atoms |
Fluorine Binding Sites:
The binding sites of Fluorine atom in the Crystal Structure of Human Dhodh in Complex with Inhibitor 1214
(pdb code 6lp6). 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 Human Dhodh in Complex with Inhibitor 1214, PDB code: 6lp6:
Jump to Fluorine binding site number: 1; 2; 3;
In total 3 binding sites of Fluorine where determined in the Crystal Structure of Human Dhodh in Complex with Inhibitor 1214, PDB code: 6lp6:
Jump to Fluorine binding site number: 1; 2; 3;
Fluorine binding site 1 out of 3 in 6lp6
Go back to
Fluorine Binding Sites List in 6lp6
Fluorine binding site 1 out
of 3 in the Crystal Structure of Human Dhodh in Complex with Inhibitor 1214
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 Human Dhodh in Complex with Inhibitor 1214 within 5.0Å range:
|
Fluorine binding site 2 out of 3 in 6lp6
Go back to
Fluorine Binding Sites List in 6lp6
Fluorine binding site 2 out
of 3 in the Crystal Structure of Human Dhodh in Complex with Inhibitor 1214
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 Human Dhodh in Complex with Inhibitor 1214 within 5.0Å range:
|
Fluorine binding site 3 out of 3 in 6lp6
Go back to
Fluorine Binding Sites List in 6lp6
Fluorine binding site 3 out
of 3 in the Crystal Structure of Human Dhodh in Complex with Inhibitor 1214
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 Human Dhodh in Complex with Inhibitor 1214 within 5.0Å range:
|
Reference:
Z.Zuo,
X.Liu,
X.Qian,
T.Zeng,
N.Sang,
H.Liu,
Y.Zhou,
L.Tao,
X.Zhou,
N.Su,
Y.Yu,
Q.Chen,
Y.Luo,
Y.Zhao.
Bifunctional Naphtho[2,3- D ][1,2,3]Triazole-4,9-Dione Compounds Exhibit Antitumor Effects in Vitro and in Vivo By Inhibiting Dihydroorotate Dehydrogenase and Inducing Reactive Oxygen Species Production. J.Med.Chem. V. 63 7633 2020.
ISSN: ISSN 0022-2623
PubMed: 32496056
DOI: 10.1021/ACS.JMEDCHEM.0C00512
Page generated: Sun Dec 13 12:56:54 2020
ISSN: ISSN 0022-2623
PubMed: 32496056
DOI: 10.1021/ACS.JMEDCHEM.0C00512
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