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Chlorine in PDB 7v18: Factor Xia in Complex with Compound 3FEnzymatic activity of Factor Xia in Complex with Compound 3F
All present enzymatic activity of Factor Xia in Complex with Compound 3F:
3.4.21.27; Protein crystallography data
The structure of Factor Xia in Complex with Compound 3F, PDB code: 7v18
was solved by
P.L.Shaffer,
C.M.Milligan,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Other elements in 7v18:
The structure of Factor Xia in Complex with Compound 3F also contains other interesting chemical elements:
Chlorine Binding Sites:
The binding sites of Chlorine atom in the Factor Xia in Complex with Compound 3F
(pdb code 7v18). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Factor Xia in Complex with Compound 3F, PDB code: 7v18: Jump to Chlorine binding site number: 1; 2; Chlorine binding site 1 out of 2 in 7v18Go back to Chlorine Binding Sites List in 7v18
Chlorine binding site 1 out
of 2 in the Factor Xia in Complex with Compound 3F
Mono view Stereo pair view
Chlorine binding site 2 out of 2 in 7v18Go back to Chlorine Binding Sites List in 7v18
Chlorine binding site 2 out
of 2 in the Factor Xia in Complex with Compound 3F
Mono view Stereo pair view
Reference:
G.Xu,
Z.Liu,
X.Wang,
T.Lu,
R.L.Desjarlais,
T.Thieu,
J.Zhang,
Z.H.Devine,
F.Du,
Q.Li,
C.M.Milligan,
P.Shaffer,
P.E.Cedervall,
J.C.Spurlino,
C.F.Stratton,
B.Pietrak,
L.M.Szewczuk,
V.Wong,
R.A.Steele,
W.Bruinzeel,
M.Chintala,
J.Silva,
M.D.Gaul,
M.J.Macielag,
R.Nargund.
Discovery of Potent and Orally Bioavailable Pyridine N-Oxide-Based Factor Xia Inhibitors Through Exploiting Nonclassical Interactions. J.Med.Chem. V. 65 10419 2022.
Page generated: Tue Jul 30 05:17:34 2024
ISSN: ISSN 0022-2623 PubMed: 35862732 DOI: 10.1021/ACS.JMEDCHEM.2C00442 |
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