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Chlorine in PDB 4o6e: Discovery of 5,6,7,8-Tetrahydropyrido[3,4-D]Pyrimidine Inhibitors of ERK2
Enzymatic activity of Discovery of 5,6,7,8-Tetrahydropyrido[3,4-D]Pyrimidine Inhibitors of ERK2
All present enzymatic activity of Discovery of 5,6,7,8-Tetrahydropyrido[3,4-D]Pyrimidine Inhibitors of ERK2:
2.7.11.24;
2.7.11.24;
Protein crystallography data
The structure of Discovery of 5,6,7,8-Tetrahydropyrido[3,4-D]Pyrimidine Inhibitors of ERK2, PDB code: 4o6e
was solved by
J.Yin,
W.Wang,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 46.67 / 1.95 |
| Space group | P 1 21 1 |
| Cell size a, b, c (Å), α, β, γ (°) | 46.850, 65.766, 52.654, 90.00, 95.00, 90.00 |
| R / Rfree (%) | 18 / 22.3 |
Other elements in 4o6e:
The structure of Discovery of 5,6,7,8-Tetrahydropyrido[3,4-D]Pyrimidine Inhibitors of ERK2 also contains other interesting chemical elements:
| Fluorine | (F) | 1 atom |
Chlorine Binding Sites:
The binding sites of Chlorine atom in the Discovery of 5,6,7,8-Tetrahydropyrido[3,4-D]Pyrimidine Inhibitors of ERK2
(pdb code 4o6e). 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 Discovery of 5,6,7,8-Tetrahydropyrido[3,4-D]Pyrimidine Inhibitors of ERK2, PDB code: 4o6e:
In total only one binding site of Chlorine was determined in the Discovery of 5,6,7,8-Tetrahydropyrido[3,4-D]Pyrimidine Inhibitors of ERK2, PDB code: 4o6e:
Chlorine binding site 1 out of 1 in 4o6e
Go back to
Chlorine Binding Sites List in 4o6e
Chlorine binding site 1 out
of 1 in the Discovery of 5,6,7,8-Tetrahydropyrido[3,4-D]Pyrimidine Inhibitors of ERK2
Mono view
Stereo pair view
Mono view
Stereo pair view
A full contact list of Chlorine with other atoms in the Cl binding
site number 1 of Discovery of 5,6,7,8-Tetrahydropyrido[3,4-D]Pyrimidine Inhibitors of ERK2 within 5.0Å range:
|
Reference:
J.F.Blake,
J.J.Gaudino,
J.De Meese,
P.Mohr,
M.Chicarelli,
H.Tian,
R.Garrey,
A.Thomas,
C.S.Siedem,
M.B.Welch,
G.Kolakowski,
R.Kaus,
M.Burkard,
M.Martinson,
H.Chen,
B.Dean,
D.A.Dudley,
S.E.Gould,
P.Pacheco,
S.Shahidi-Latham,
W.Wang,
K.West,
J.Yin,
J.Moffat,
J.B.Schwarz.
Discovery of 5,6,7,8-Tetrahydropyrido[3,4-D]Pyrimidine Inhibitors of ERK2. Bioorg.Med.Chem.Lett. V. 24 2635 2014.
ISSN: ISSN 0960-894X
PubMed: 24813737
DOI: 10.1016/J.BMCL.2014.04.068
Page generated: Sat Dec 12 11:00:07 2020
ISSN: ISSN 0960-894X
PubMed: 24813737
DOI: 10.1016/J.BMCL.2014.04.068
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