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Atomistry » Manganese » PDB 6dkt-6e4c » 6dq8 | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Atomistry » Manganese » PDB 6dkt-6e4c » 6dq8 » |
Manganese in PDB 6dq8: Linked KDM5A Jmj Domain Bound to the Inhibitor N49 I.E. 2-((2- Chlorophenyl)(2-(1-Methylpyrrolidin-2-Yl)Ethoxy)Methyl)Thieno[3,2- B]Pyridine-7-Carboxylic AcidProtein crystallography data
The structure of Linked KDM5A Jmj Domain Bound to the Inhibitor N49 I.E. 2-((2- Chlorophenyl)(2-(1-Methylpyrrolidin-2-Yl)Ethoxy)Methyl)Thieno[3,2- B]Pyridine-7-Carboxylic Acid, PDB code: 6dq8
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 6dq8:
The structure of Linked KDM5A Jmj Domain Bound to the Inhibitor N49 I.E. 2-((2- Chlorophenyl)(2-(1-Methylpyrrolidin-2-Yl)Ethoxy)Methyl)Thieno[3,2- B]Pyridine-7-Carboxylic Acid also contains other interesting chemical elements:
Manganese Binding Sites:
The binding sites of Manganese atom in the Linked KDM5A Jmj Domain Bound to the Inhibitor N49 I.E. 2-((2- Chlorophenyl)(2-(1-Methylpyrrolidin-2-Yl)Ethoxy)Methyl)Thieno[3,2- B]Pyridine-7-Carboxylic Acid
(pdb code 6dq8). This binding sites where shown within
5.0 Angstroms radius around Manganese atom.
In total only one binding site of Manganese was determined in the Linked KDM5A Jmj Domain Bound to the Inhibitor N49 I.E. 2-((2- Chlorophenyl)(2-(1-Methylpyrrolidin-2-Yl)Ethoxy)Methyl)Thieno[3,2- B]Pyridine-7-Carboxylic Acid, PDB code: 6dq8: Manganese binding site 1 out of 1 in 6dq8Go back to Manganese Binding Sites List in 6dq8
Manganese binding site 1 out
of 1 in the Linked KDM5A Jmj Domain Bound to the Inhibitor N49 I.E. 2-((2- Chlorophenyl)(2-(1-Methylpyrrolidin-2-Yl)Ethoxy)Methyl)Thieno[3,2- B]Pyridine-7-Carboxylic Acid
Mono view Stereo pair view
Reference:
J.R.Horton,
C.B.Woodcock,
Q.Chen,
X.Liu,
X.Zhang,
J.Shanks,
G.Rai,
B.T.Mott,
D.J.Jansen,
S.C.Kales,
M.J.Henderson,
M.Cyr,
K.Pohida,
X.Hu,
P.Shah,
X.Xu,
A.Jadhav,
D.J.Maloney,
M.D.Hall,
A.Simeonov,
H.Fu,
P.M.Vertino,
X.Cheng.
Structure-Based Engineering of Irreversible Inhibitors Against Histone Lysine Demethylase KDM5A. J. Med. Chem. V. 61 10588 2018.
Page generated: Tue Dec 15 04:51:59 2020
ISSN: ISSN 1520-4804 PubMed: 30392349 DOI: 10.1021/ACS.JMEDCHEM.8B01219 |
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