Fluorine in PDB 8i71: Hepatitis B Virus Core Protein Y132A Mutant in Complex with Linvencorvir (RG7907), A Hepatitis B Virus (Hbv) Core Protein Allosteric Modulator (Cpam)
Protein crystallography data
The structure of Hepatitis B Virus Core Protein Y132A Mutant in Complex with Linvencorvir (RG7907), A Hepatitis B Virus (Hbv) Core Protein Allosteric Modulator (Cpam), PDB code: 8i71
was solved by
Z.Zhou,
Z.H.Xu,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 33.51 / 1.60 |
| Space group | P 1 |
| Cell size a, b, c (Å), α, β, γ (°) | 64.392, 67.565, 86.246, 68.6, 69.81, 83.87 |
| R / Rfree (%) | 15.5 / 19.3 |
Other elements in 8i71:
The structure of Hepatitis B Virus Core Protein Y132A Mutant in Complex with Linvencorvir (RG7907), A Hepatitis B Virus (Hbv) Core Protein Allosteric Modulator (Cpam) also contains other interesting chemical elements:
| Chlorine | (Cl) | 5 atoms |
Fluorine Binding Sites:
The binding sites of Fluorine atom in the Hepatitis B Virus Core Protein Y132A Mutant in Complex with Linvencorvir (RG7907), A Hepatitis B Virus (Hbv) Core Protein Allosteric Modulator (Cpam)
(pdb code 8i71). This binding sites where shown within
5.0 Angstroms radius around Fluorine atom.
In total 6 binding sites of Fluorine where determined in the Hepatitis B Virus Core Protein Y132A Mutant in Complex with Linvencorvir (RG7907), A Hepatitis B Virus (Hbv) Core Protein Allosteric Modulator (Cpam), PDB code: 8i71:
Jump to Fluorine binding site number: 1; 2; 3; 4; 5; 6;
In total 6 binding sites of Fluorine where determined in the Hepatitis B Virus Core Protein Y132A Mutant in Complex with Linvencorvir (RG7907), A Hepatitis B Virus (Hbv) Core Protein Allosteric Modulator (Cpam), PDB code: 8i71:
Jump to Fluorine binding site number: 1; 2; 3; 4; 5; 6;
Fluorine binding site 1 out of 6 in 8i71
Go back to
Fluorine Binding Sites List in 8i71
Fluorine binding site 1 out
of 6 in the Hepatitis B Virus Core Protein Y132A Mutant in Complex with Linvencorvir (RG7907), A Hepatitis B Virus (Hbv) Core Protein Allosteric Modulator (Cpam)
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 Hepatitis B Virus Core Protein Y132A Mutant in Complex with Linvencorvir (RG7907), A Hepatitis B Virus (Hbv) Core Protein Allosteric Modulator (Cpam) within 5.0Å range:
|
Fluorine binding site 2 out of 6 in 8i71
Go back to
Fluorine Binding Sites List in 8i71
Fluorine binding site 2 out
of 6 in the Hepatitis B Virus Core Protein Y132A Mutant in Complex with Linvencorvir (RG7907), A Hepatitis B Virus (Hbv) Core Protein Allosteric Modulator (Cpam)
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 Hepatitis B Virus Core Protein Y132A Mutant in Complex with Linvencorvir (RG7907), A Hepatitis B Virus (Hbv) Core Protein Allosteric Modulator (Cpam) within 5.0Å range:
|
Fluorine binding site 3 out of 6 in 8i71
Go back to
Fluorine Binding Sites List in 8i71
Fluorine binding site 3 out
of 6 in the Hepatitis B Virus Core Protein Y132A Mutant in Complex with Linvencorvir (RG7907), A Hepatitis B Virus (Hbv) Core Protein Allosteric Modulator (Cpam)
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 Hepatitis B Virus Core Protein Y132A Mutant in Complex with Linvencorvir (RG7907), A Hepatitis B Virus (Hbv) Core Protein Allosteric Modulator (Cpam) within 5.0Å range:
|
Fluorine binding site 4 out of 6 in 8i71
Go back to
Fluorine Binding Sites List in 8i71
Fluorine binding site 4 out
of 6 in the Hepatitis B Virus Core Protein Y132A Mutant in Complex with Linvencorvir (RG7907), A Hepatitis B Virus (Hbv) Core Protein Allosteric Modulator (Cpam)
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 Hepatitis B Virus Core Protein Y132A Mutant in Complex with Linvencorvir (RG7907), A Hepatitis B Virus (Hbv) Core Protein Allosteric Modulator (Cpam) within 5.0Å range:
|
Fluorine binding site 5 out of 6 in 8i71
Go back to
Fluorine Binding Sites List in 8i71
Fluorine binding site 5 out
of 6 in the Hepatitis B Virus Core Protein Y132A Mutant in Complex with Linvencorvir (RG7907), A Hepatitis B Virus (Hbv) Core Protein Allosteric Modulator (Cpam)
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 Hepatitis B Virus Core Protein Y132A Mutant in Complex with Linvencorvir (RG7907), A Hepatitis B Virus (Hbv) Core Protein Allosteric Modulator (Cpam) within 5.0Å range:
|
Fluorine binding site 6 out of 6 in 8i71
Go back to
Fluorine Binding Sites List in 8i71
Fluorine binding site 6 out
of 6 in the Hepatitis B Virus Core Protein Y132A Mutant in Complex with Linvencorvir (RG7907), A Hepatitis B Virus (Hbv) Core Protein Allosteric Modulator (Cpam)
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 Hepatitis B Virus Core Protein Y132A Mutant in Complex with Linvencorvir (RG7907), A Hepatitis B Virus (Hbv) Core Protein Allosteric Modulator (Cpam) within 5.0Å range:
|
Reference:
W.Zhang,
L.Guo,
H.Liu,
G.Wu,
H.Shi,
M.Zhou,
Z.Zhang,
B.Kou,
T.Hu,
Z.Zhou,
Z.Xu,
X.Zhou,
Y.Zhou,
X.Tian,
G.Yang,
J.A.T.Young,
H.Qiu,
G.Ottaviani,
J.Xie,
A.V.Mayweg,
H.C.Shen,
W.Zhu.
Discovery of Linvencorvir (RG7907), A Hepatitis B Virus Core Protein Allosteric Modulator, For the Treatment of Chronic Hbv Infection. J.Med.Chem. 2023.
ISSN: ISSN 0022-2623
PubMed: 36896968
DOI: 10.1021/ACS.JMEDCHEM.3C00173
Page generated: Fri Aug 2 20:34:06 2024
ISSN: ISSN 0022-2623
PubMed: 36896968
DOI: 10.1021/ACS.JMEDCHEM.3C00173
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