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Atomistry » Fluorine » PDB 4x7j-4xxs » 4xjs » |
Fluorine in PDB 4xjs: Human CD38 Complexed with Inhibitor 1 [6-Fluoro-2-Methyl-4-[(2,3,6- Trichlorobenzyl)Amino]Quinoline-8-Carboxamide]Enzymatic activity of Human CD38 Complexed with Inhibitor 1 [6-Fluoro-2-Methyl-4-[(2,3,6- Trichlorobenzyl)Amino]Quinoline-8-Carboxamide]
All present enzymatic activity of Human CD38 Complexed with Inhibitor 1 [6-Fluoro-2-Methyl-4-[(2,3,6- Trichlorobenzyl)Amino]Quinoline-8-Carboxamide]:
2.4.99.20; 3.2.2.6; Protein crystallography data
The structure of Human CD38 Complexed with Inhibitor 1 [6-Fluoro-2-Methyl-4-[(2,3,6- Trichlorobenzyl)Amino]Quinoline-8-Carboxamide], PDB code: 4xjs
was solved by
L.M.Shewchuk,
D.Deaton,
E.Stewart,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Other elements in 4xjs:
The structure of Human CD38 Complexed with Inhibitor 1 [6-Fluoro-2-Methyl-4-[(2,3,6- Trichlorobenzyl)Amino]Quinoline-8-Carboxamide] also contains other interesting chemical elements:
Fluorine Binding Sites:
The binding sites of Fluorine atom in the Human CD38 Complexed with Inhibitor 1 [6-Fluoro-2-Methyl-4-[(2,3,6- Trichlorobenzyl)Amino]Quinoline-8-Carboxamide]
(pdb code 4xjs). This binding sites where shown within
5.0 Angstroms radius around Fluorine atom.
In total only one binding site of Fluorine was determined in the Human CD38 Complexed with Inhibitor 1 [6-Fluoro-2-Methyl-4-[(2,3,6- Trichlorobenzyl)Amino]Quinoline-8-Carboxamide], PDB code: 4xjs: Fluorine binding site 1 out of 1 in 4xjsGo back to Fluorine Binding Sites List in 4xjs
Fluorine binding site 1 out
of 1 in the Human CD38 Complexed with Inhibitor 1 [6-Fluoro-2-Methyl-4-[(2,3,6- Trichlorobenzyl)Amino]Quinoline-8-Carboxamide]
Mono view Stereo pair view
Reference:
J.D.Becherer,
E.E.Boros,
T.Y.Carpenter,
D.J.Cowan,
D.N.Deaton,
C.D.Haffner,
M.R.Jeune,
I.W.Kaldor,
J.C.Poole,
F.Preugschat,
T.R.Rheault,
C.A.Schulte,
B.G.Shearer,
T.W.Shearer,
L.M.Shewchuk,
T.L.Smalley,
E.L.Stewart,
J.D.Stuart,
J.C.Ulrich.
Discovery of 4-Amino-8-Quinoline Carboxamides As Novel, Submicromolar Inhibitors of Nad-Hydrolyzing Enzyme CD38. J.Med.Chem. V. 58 7021 2015.
Page generated: Thu Aug 1 06:42:31 2024
ISSN: ISSN 0022-2623 PubMed: 26267483 DOI: 10.1021/ACS.JMEDCHEM.5B00992 |
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