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Fluorine in PDB 7wl4: Crystal Structure of the First Bromodomain of Human BRD4 in Complex with the Inhibitor Slp-50
Protein crystallography data
The structure of Crystal Structure of the First Bromodomain of Human BRD4 in Complex with the Inhibitor Slp-50, PDB code: 7wl4
was solved by
C.Zhang,
C.Wang,
W.Li,
Y.Zhang,
Y.Xu,
L.Sun,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 107.31 / 1.82 |
| Space group | P 1 21 1 |
| Cell size a, b, c (Å), α, β, γ (°) | 59.858, 42.484, 107.309, 90, 90, 90 |
| R / Rfree (%) | 18.4 / 22.1 |
Fluorine Binding Sites:
The binding sites of Fluorine atom in the Crystal Structure of the First Bromodomain of Human BRD4 in Complex with the Inhibitor Slp-50
(pdb code 7wl4). This binding sites where shown within
5.0 Angstroms radius around Fluorine atom.
In total 8 binding sites of Fluorine where determined in the Crystal Structure of the First Bromodomain of Human BRD4 in Complex with the Inhibitor Slp-50, PDB code: 7wl4:
Jump to Fluorine binding site number: 1; 2; 3; 4; 5; 6; 7; 8;
In total 8 binding sites of Fluorine where determined in the Crystal Structure of the First Bromodomain of Human BRD4 in Complex with the Inhibitor Slp-50, PDB code: 7wl4:
Jump to Fluorine binding site number: 1; 2; 3; 4; 5; 6; 7; 8;
Fluorine binding site 1 out of 8 in 7wl4
Go back to
Fluorine Binding Sites List in 7wl4
Fluorine binding site 1 out
of 8 in the Crystal Structure of the First Bromodomain of Human BRD4 in Complex with the Inhibitor Slp-50
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 the First Bromodomain of Human BRD4 in Complex with the Inhibitor Slp-50 within 5.0Å range:
|
Fluorine binding site 2 out of 8 in 7wl4
Go back to
Fluorine Binding Sites List in 7wl4
Fluorine binding site 2 out
of 8 in the Crystal Structure of the First Bromodomain of Human BRD4 in Complex with the Inhibitor Slp-50
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 the First Bromodomain of Human BRD4 in Complex with the Inhibitor Slp-50 within 5.0Å range:
|
Fluorine binding site 3 out of 8 in 7wl4
Go back to
Fluorine Binding Sites List in 7wl4
Fluorine binding site 3 out
of 8 in the Crystal Structure of the First Bromodomain of Human BRD4 in Complex with the Inhibitor Slp-50
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 the First Bromodomain of Human BRD4 in Complex with the Inhibitor Slp-50 within 5.0Å range:
|
Fluorine binding site 4 out of 8 in 7wl4
Go back to
Fluorine Binding Sites List in 7wl4
Fluorine binding site 4 out
of 8 in the Crystal Structure of the First Bromodomain of Human BRD4 in Complex with the Inhibitor Slp-50
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 4 of Crystal Structure of the First Bromodomain of Human BRD4 in Complex with the Inhibitor Slp-50 within 5.0Å range:
|
Fluorine binding site 5 out of 8 in 7wl4
Go back to
Fluorine Binding Sites List in 7wl4
Fluorine binding site 5 out
of 8 in the Crystal Structure of the First Bromodomain of Human BRD4 in Complex with the Inhibitor Slp-50
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 5 of Crystal Structure of the First Bromodomain of Human BRD4 in Complex with the Inhibitor Slp-50 within 5.0Å range:
|
Fluorine binding site 6 out of 8 in 7wl4
Go back to
Fluorine Binding Sites List in 7wl4
Fluorine binding site 6 out
of 8 in the Crystal Structure of the First Bromodomain of Human BRD4 in Complex with the Inhibitor Slp-50
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 6 of Crystal Structure of the First Bromodomain of Human BRD4 in Complex with the Inhibitor Slp-50 within 5.0Å range:
|
Fluorine binding site 7 out of 8 in 7wl4
Go back to
Fluorine Binding Sites List in 7wl4
Fluorine binding site 7 out
of 8 in the Crystal Structure of the First Bromodomain of Human BRD4 in Complex with the Inhibitor Slp-50
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 7 of Crystal Structure of the First Bromodomain of Human BRD4 in Complex with the Inhibitor Slp-50 within 5.0Å range:
|
Fluorine binding site 8 out of 8 in 7wl4
Go back to
Fluorine Binding Sites List in 7wl4
Fluorine binding site 8 out
of 8 in the Crystal Structure of the First Bromodomain of Human BRD4 in Complex with the Inhibitor Slp-50
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 8 of Crystal Structure of the First Bromodomain of Human BRD4 in Complex with the Inhibitor Slp-50 within 5.0Å range:
|
Reference:
W.Li,
C.Zhang,
H.E.Zhang,
R.Dong,
J.Y.Liu,
C.M.Wang,
M.Wang,
Y.W.Wang,
C.Wang,
Y.Zhang,
L.Shi,
Y.Xu,
L.P.Sun.
Design, Synthesis, and Anticancer Evaluation of Ammosamide B with Pyrroloquinoline Derivatives As Novel BRD4 Inhibitors. Bioorg.Chem. V. 127 05917 2022.
ISSN: ISSN 0045-2068
PubMed: 35738217
DOI: 10.1016/J.BIOORG.2022.105917
Page generated: Fri Aug 2 14:50:25 2024
ISSN: ISSN 0045-2068
PubMed: 35738217
DOI: 10.1016/J.BIOORG.2022.105917
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