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Atomistry » Fluorine » PDB 4zzj-5ah8 » 4zzy | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Atomistry » Fluorine » PDB 4zzj-5ah8 » 4zzy » |
Fluorine in PDB 4zzy: Structure of Human PARP2 Catalytic Domain Bound to An Isoindolinone InhibitorEnzymatic activity of Structure of Human PARP2 Catalytic Domain Bound to An Isoindolinone Inhibitor
All present enzymatic activity of Structure of Human PARP2 Catalytic Domain Bound to An Isoindolinone Inhibitor:
2.4.2.30; Protein crystallography data
The structure of Structure of Human PARP2 Catalytic Domain Bound to An Isoindolinone Inhibitor, PDB code: 4zzy
was solved by
E.Casale,
M.Fasolini,
G.Papeo,
H.Posteri,
D.Borghi,
A.A.Busel,
F.Caprera,
M.Ciomei,
A.Cirla,
E.Corti,
M.Danello,
M.Fasolini,
E.R.Felder,
B.Forte,
A.Galvani,
A.Isacchi,
A.Khvat,
M.Y.Krasavin,
R.Lupi,
P.Orsini,
R.Perego,
E.Pesenti,
D.Pezzetta,
S.Rainoldi,
F.Riccardisirtori,
A.Scolaro,
F.Sola,
F.Zuccotto,
D.Donati,
A.Montagnoli,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Fluorine Binding Sites:
The binding sites of Fluorine atom in the Structure of Human PARP2 Catalytic Domain Bound to An Isoindolinone Inhibitor
(pdb code 4zzy). This binding sites where shown within
5.0 Angstroms radius around Fluorine atom.
In total 3 binding sites of Fluorine where determined in the Structure of Human PARP2 Catalytic Domain Bound to An Isoindolinone Inhibitor, PDB code: 4zzy: Jump to Fluorine binding site number: 1; 2; 3; Fluorine binding site 1 out of 3 in 4zzyGo back to Fluorine Binding Sites List in 4zzy
Fluorine binding site 1 out
of 3 in the Structure of Human PARP2 Catalytic Domain Bound to An Isoindolinone Inhibitor
Mono view Stereo pair view
Fluorine binding site 2 out of 3 in 4zzyGo back to Fluorine Binding Sites List in 4zzy
Fluorine binding site 2 out
of 3 in the Structure of Human PARP2 Catalytic Domain Bound to An Isoindolinone Inhibitor
Mono view Stereo pair view
Fluorine binding site 3 out of 3 in 4zzyGo back to Fluorine Binding Sites List in 4zzy
Fluorine binding site 3 out
of 3 in the Structure of Human PARP2 Catalytic Domain Bound to An Isoindolinone Inhibitor
Mono view Stereo pair view
Reference:
G.M.E.Papeo,
H.Posteri,
D.Borghi,
A.A.Busel,
F.Caprera,
E.Casale,
M.Ciomei,
A.Cirla,
E.Corti,
M.D'anello,
M.Fasolini,
B.Forte,
A.Galvani,
A.Isacchi,
A.Khvat,
M.Y.Krasavin,
R.Lupi,
P.Orsini,
R.Perego,
E.Pesenti,
D.Pezzetta,
S.Rainoldi,
F.Riccardi-Sirtori,
A.Scolaro,
F.Sola,
F.Zuccotto,
E.R.Felder,
D.Donati,
A.Montagnoli.
Discovery of 2-[1-(4,4-Difluorocyclohexyl)Piperidin-4-Yl]-6- Fluoro-3-Oxo-2,3-Dihydro-1H-Isoindole-4-Carboxamide (Nms- P118): A Potent, Orally Available and Highly Selective Parp- 1 Inhibitor For Cancer Therapy. J.Med.Chem. V. 58 6875 2015.
Page generated: Sun Dec 13 12:17:44 2020
ISSN: ISSN 0022-2623 PubMed: 26222319 DOI: 10.1021/ACS.JMEDCHEM.5B00680 |
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