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Chlorine in PDB 4mq1: The Crystal Structure of DYRK1A with A Bound Pyrido[2,3-D]Pyrimidine Inhibitor
Enzymatic activity of The Crystal Structure of DYRK1A with A Bound Pyrido[2,3-D]Pyrimidine Inhibitor
All present enzymatic activity of The Crystal Structure of DYRK1A with A Bound Pyrido[2,3-D]Pyrimidine Inhibitor:
2.7.12.1;
2.7.12.1;
Protein crystallography data
The structure of The Crystal Structure of DYRK1A with A Bound Pyrido[2,3-D]Pyrimidine Inhibitor, PDB code: 4mq1
was solved by
C.M.Lukacs,
C.A.Janson,
C.Garvie,
L.Liang,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 39.83 / 2.35 |
| Space group | C 1 2 1 |
| Cell size a, b, c (Å), α, β, γ (°) | 263.843, 64.939, 140.461, 90.00, 115.16, 90.00 |
| R / Rfree (%) | 20.2 / 24.6 |
Chlorine Binding Sites:
The binding sites of Chlorine atom in the The Crystal Structure of DYRK1A with A Bound Pyrido[2,3-D]Pyrimidine Inhibitor
(pdb code 4mq1). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total 8 binding sites of Chlorine where determined in the The Crystal Structure of DYRK1A with A Bound Pyrido[2,3-D]Pyrimidine Inhibitor, PDB code: 4mq1:
Jump to Chlorine binding site number: 1; 2; 3; 4; 5; 6; 7; 8;
In total 8 binding sites of Chlorine where determined in the The Crystal Structure of DYRK1A with A Bound Pyrido[2,3-D]Pyrimidine Inhibitor, PDB code: 4mq1:
Jump to Chlorine binding site number: 1; 2; 3; 4; 5; 6; 7; 8;
Chlorine binding site 1 out of 8 in 4mq1
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Chlorine Binding Sites List in 4mq1
Chlorine binding site 1 out
of 8 in the The Crystal Structure of DYRK1A with A Bound Pyrido[2,3-D]Pyrimidine Inhibitor
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 The Crystal Structure of DYRK1A with A Bound Pyrido[2,3-D]Pyrimidine Inhibitor within 5.0Å range:
|
Chlorine binding site 2 out of 8 in 4mq1
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Chlorine Binding Sites List in 4mq1
Chlorine binding site 2 out
of 8 in the The Crystal Structure of DYRK1A with A Bound Pyrido[2,3-D]Pyrimidine Inhibitor
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 2 of The Crystal Structure of DYRK1A with A Bound Pyrido[2,3-D]Pyrimidine Inhibitor within 5.0Å range:
|
Chlorine binding site 3 out of 8 in 4mq1
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Chlorine Binding Sites List in 4mq1
Chlorine binding site 3 out
of 8 in the The Crystal Structure of DYRK1A with A Bound Pyrido[2,3-D]Pyrimidine Inhibitor
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 3 of The Crystal Structure of DYRK1A with A Bound Pyrido[2,3-D]Pyrimidine Inhibitor within 5.0Å range:
|
Chlorine binding site 4 out of 8 in 4mq1
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Chlorine Binding Sites List in 4mq1
Chlorine binding site 4 out
of 8 in the The Crystal Structure of DYRK1A with A Bound Pyrido[2,3-D]Pyrimidine Inhibitor
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 4 of The Crystal Structure of DYRK1A with A Bound Pyrido[2,3-D]Pyrimidine Inhibitor within 5.0Å range:
|
Chlorine binding site 5 out of 8 in 4mq1
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Chlorine Binding Sites List in 4mq1
Chlorine binding site 5 out
of 8 in the The Crystal Structure of DYRK1A with A Bound Pyrido[2,3-D]Pyrimidine Inhibitor
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 5 of The Crystal Structure of DYRK1A with A Bound Pyrido[2,3-D]Pyrimidine Inhibitor within 5.0Å range:
|
Chlorine binding site 6 out of 8 in 4mq1
Go back to
Chlorine Binding Sites List in 4mq1
Chlorine binding site 6 out
of 8 in the The Crystal Structure of DYRK1A with A Bound Pyrido[2,3-D]Pyrimidine Inhibitor
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 6 of The Crystal Structure of DYRK1A with A Bound Pyrido[2,3-D]Pyrimidine Inhibitor within 5.0Å range:
|
Chlorine binding site 7 out of 8 in 4mq1
Go back to
Chlorine Binding Sites List in 4mq1
Chlorine binding site 7 out
of 8 in the The Crystal Structure of DYRK1A with A Bound Pyrido[2,3-D]Pyrimidine Inhibitor
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 7 of The Crystal Structure of DYRK1A with A Bound Pyrido[2,3-D]Pyrimidine Inhibitor within 5.0Å range:
|
Chlorine binding site 8 out of 8 in 4mq1
Go back to
Chlorine Binding Sites List in 4mq1
Chlorine binding site 8 out
of 8 in the The Crystal Structure of DYRK1A with A Bound Pyrido[2,3-D]Pyrimidine Inhibitor
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 8 of The Crystal Structure of DYRK1A with A Bound Pyrido[2,3-D]Pyrimidine Inhibitor within 5.0Å range:
|
Reference:
K.Anderson,
Y.Chen,
Z.Chen,
R.Dominique,
K.Glenn,
Y.He,
C.Janson,
K.C.Luk,
C.Lukacs,
A.Polonskaia,
Q.Qiao,
A.Railkar,
P.Rossman,
H.Sun,
Q.Xiang,
M.Vilenchik,
P.Wovkulich,
X.Zhang.
Pyrido[2,3-D]Pyrimidines: Discovery and Preliminary Sar of A Novel Series of DYRK1B and DYRK1A Inhibitors. Bioorg.Med.Chem.Lett. V. 23 6610 2013.
ISSN: ISSN 0960-894X
PubMed: 24239188
DOI: 10.1016/J.BMCL.2013.10.055
Page generated: Fri Jul 11 19:15:44 2025
ISSN: ISSN 0960-894X
PubMed: 24239188
DOI: 10.1016/J.BMCL.2013.10.055
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