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Chlorine in PDB 6bgv: Linked KDM5A Jmj Domain Bound to the Inhibitor 2-((2-Chlorophenyl)(2- (Piperidin-1-Yl)Ethoxy)Methyl)-1L2-Pyrrolo[3,2-B]Pyridine-7- Carboxylic Acid (Compound N40)Protein crystallography data
The structure of Linked KDM5A Jmj Domain Bound to the Inhibitor 2-((2-Chlorophenyl)(2- (Piperidin-1-Yl)Ethoxy)Methyl)-1L2-Pyrrolo[3,2-B]Pyridine-7- Carboxylic Acid (Compound N40), PDB code: 6bgv
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 6bgv:
The structure of Linked KDM5A Jmj Domain Bound to the Inhibitor 2-((2-Chlorophenyl)(2- (Piperidin-1-Yl)Ethoxy)Methyl)-1L2-Pyrrolo[3,2-B]Pyridine-7- Carboxylic Acid (Compound N40) 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)(2- (Piperidin-1-Yl)Ethoxy)Methyl)-1L2-Pyrrolo[3,2-B]Pyridine-7- Carboxylic Acid (Compound N40)
(pdb code 6bgv). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Linked KDM5A Jmj Domain Bound to the Inhibitor 2-((2-Chlorophenyl)(2- (Piperidin-1-Yl)Ethoxy)Methyl)-1L2-Pyrrolo[3,2-B]Pyridine-7- Carboxylic Acid (Compound N40), PDB code: 6bgv: Jump to Chlorine binding site number: 1; 2; Chlorine binding site 1 out of 2 in 6bgvGo back to Chlorine Binding Sites List in 6bgv
Chlorine binding site 1 out
of 2 in the Linked KDM5A Jmj Domain Bound to the Inhibitor 2-((2-Chlorophenyl)(2- (Piperidin-1-Yl)Ethoxy)Methyl)-1L2-Pyrrolo[3,2-B]Pyridine-7- Carboxylic Acid (Compound N40)
Mono view Stereo pair view
Chlorine binding site 2 out of 2 in 6bgvGo back to Chlorine Binding Sites List in 6bgv
Chlorine binding site 2 out
of 2 in the Linked KDM5A Jmj Domain Bound to the Inhibitor 2-((2-Chlorophenyl)(2- (Piperidin-1-Yl)Ethoxy)Methyl)-1L2-Pyrrolo[3,2-B]Pyridine-7- Carboxylic Acid (Compound N40)
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: Sat Dec 12 12:46:17 2020
ISSN: ISSN 1520-4804 PubMed: 29537847 DOI: 10.1021/ACS.JMEDCHEM.8B00261 |
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