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Atomistry » Chlorine » PDB 5c2c-5cai » 5c2h | |||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Atomistry » Chlorine » PDB 5c2c-5cai » 5c2h » |
Chlorine in PDB 5c2h: PDE10 Complexed with 6-Chloro-N-[(2,4-Dimethylthiazol-5-Yl)Methyl]-5- Methyl-2-[3-(2-Quinolyl)Propoxy]Pyrimidin-4-AmineEnzymatic activity of PDE10 Complexed with 6-Chloro-N-[(2,4-Dimethylthiazol-5-Yl)Methyl]-5- Methyl-2-[3-(2-Quinolyl)Propoxy]Pyrimidin-4-Amine
All present enzymatic activity of PDE10 Complexed with 6-Chloro-N-[(2,4-Dimethylthiazol-5-Yl)Methyl]-5- Methyl-2-[3-(2-Quinolyl)Propoxy]Pyrimidin-4-Amine:
3.1.4.17; 3.1.4.35; Protein crystallography data
The structure of PDE10 Complexed with 6-Chloro-N-[(2,4-Dimethylthiazol-5-Yl)Methyl]-5- Methyl-2-[3-(2-Quinolyl)Propoxy]Pyrimidin-4-Amine, PDB code: 5c2h
was solved by
Y.Yan,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Other elements in 5c2h:
The structure of PDE10 Complexed with 6-Chloro-N-[(2,4-Dimethylthiazol-5-Yl)Methyl]-5- Methyl-2-[3-(2-Quinolyl)Propoxy]Pyrimidin-4-Amine also contains other interesting chemical elements:
Chlorine Binding Sites:
The binding sites of Chlorine atom in the PDE10 Complexed with 6-Chloro-N-[(2,4-Dimethylthiazol-5-Yl)Methyl]-5- Methyl-2-[3-(2-Quinolyl)Propoxy]Pyrimidin-4-Amine
(pdb code 5c2h). 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 PDE10 Complexed with 6-Chloro-N-[(2,4-Dimethylthiazol-5-Yl)Methyl]-5- Methyl-2-[3-(2-Quinolyl)Propoxy]Pyrimidin-4-Amine, PDB code: 5c2h: Chlorine binding site 1 out of 1 in 5c2hGo back to Chlorine Binding Sites List in 5c2h
Chlorine binding site 1 out
of 1 in the PDE10 Complexed with 6-Chloro-N-[(2,4-Dimethylthiazol-5-Yl)Methyl]-5- Methyl-2-[3-(2-Quinolyl)Propoxy]Pyrimidin-4-Amine
Mono view Stereo pair view
Reference:
W.D.Shipe,
S.S.Sharik,
J.C.Barrow,
G.B.Mcgaughey,
C.R.Theberge,
J.M.Uslaner,
Y.Yan,
J.J.Renger,
S.M.Smith,
P.J.Coleman,
C.D.Cox.
Discovery and Optimization of A Series of Pyrimidine-Based Phosphodiesterase 10A (PDE10A) Inhibitors Through Fragment Screening, Structure-Based Design, and Parallel Synthesis. J.Med.Chem. V. 58 7888 2015.
Page generated: Fri Jul 26 05:53:36 2024
ISSN: ISSN 0022-2623 PubMed: 26378882 DOI: 10.1021/ACS.JMEDCHEM.5B00983 |
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