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Atomistry » Chlorine » PDB 6bb3-6bmc » 6bgx | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Atomistry » Chlorine » PDB 6bb3-6bmc » 6bgx » |
Chlorine in PDB 6bgx: Linked KDM5A Jmj Domain Bound to the Inhibitor 2-((2-Chlorophenyl)((4, 4-Difluorocyclohexyl)Methoxy)Methyl)-1H-Pyrrolo[3,2-B]Pyridine-7- Carboxylic Acid(Compound N42)Protein crystallography data
The structure of Linked KDM5A Jmj Domain Bound to the Inhibitor 2-((2-Chlorophenyl)((4, 4-Difluorocyclohexyl)Methoxy)Methyl)-1H-Pyrrolo[3,2-B]Pyridine-7- Carboxylic Acid(Compound N42), PDB code: 6bgx
was solved by
J.R.Horton,
X.Cheng,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Other elements in 6bgx:
The structure of Linked KDM5A Jmj Domain Bound to the Inhibitor 2-((2-Chlorophenyl)((4, 4-Difluorocyclohexyl)Methoxy)Methyl)-1H-Pyrrolo[3,2-B]Pyridine-7- Carboxylic Acid(Compound N42) also contains other interesting chemical elements:
Chlorine Binding Sites:
The binding sites of Chlorine atom in the Linked KDM5A Jmj Domain Bound to the Inhibitor 2-((2-Chlorophenyl)((4, 4-Difluorocyclohexyl)Methoxy)Methyl)-1H-Pyrrolo[3,2-B]Pyridine-7- Carboxylic Acid(Compound N42)
(pdb code 6bgx). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total only one binding site of Chlorine was determined in the Linked KDM5A Jmj Domain Bound to the Inhibitor 2-((2-Chlorophenyl)((4, 4-Difluorocyclohexyl)Methoxy)Methyl)-1H-Pyrrolo[3,2-B]Pyridine-7- Carboxylic Acid(Compound N42), PDB code: 6bgx: Chlorine binding site 1 out of 1 in 6bgxGo back to![]() ![]()
Chlorine binding site 1 out
of 1 in the Linked KDM5A Jmj Domain Bound to the Inhibitor 2-((2-Chlorophenyl)((4, 4-Difluorocyclohexyl)Methoxy)Methyl)-1H-Pyrrolo[3,2-B]Pyridine-7- Carboxylic Acid(Compound N42)
![]() Mono view ![]() Stereo pair view
Reference:
J.R.Horton,
X.Liu,
L.Wu,
K.Zhang,
J.Shanks,
X.Zhang,
G.Rai,
B.T.Mott,
D.J.Jansen,
S.C.Kales,
M.J.Henderson,
K.Pohida,
Y.Fang,
X.Hu,
A.Jadhav,
D.J.Maloney,
M.D.Hall,
A.Simeonov,
H.Fu,
P.M.Vertino,
Q.Yan,
X.Cheng.
Insights Into the Action of Inhibitor Enantiomers Against Histone Lysine Demethylase 5A. J. Med. Chem. V. 61 3193 2018.
Page generated: Fri Jul 26 22:49:05 2024
ISSN: ISSN 1520-4804 PubMed: 29537847 DOI: 10.1021/ACS.JMEDCHEM.8B00261 |
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