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Chlorine in PDB 6d1y: Crystal Structure of Tyrosine-Protein Kinase Receptor in Complex with 2,4-Dichloro-N-(3-Methyl-1-Phenyl-1H-Pyrazol-5-Yl)Benzamide Inhibitor
Enzymatic activity of Crystal Structure of Tyrosine-Protein Kinase Receptor in Complex with 2,4-Dichloro-N-(3-Methyl-1-Phenyl-1H-Pyrazol-5-Yl)Benzamide Inhibitor
All present enzymatic activity of Crystal Structure of Tyrosine-Protein Kinase Receptor in Complex with 2,4-Dichloro-N-(3-Methyl-1-Phenyl-1H-Pyrazol-5-Yl)Benzamide Inhibitor:
2.7.10.1;
2.7.10.1;
Protein crystallography data
The structure of Crystal Structure of Tyrosine-Protein Kinase Receptor in Complex with 2,4-Dichloro-N-(3-Methyl-1-Phenyl-1H-Pyrazol-5-Yl)Benzamide Inhibitor, PDB code: 6d1y
was solved by
S.E.Greasley,
E.Johnson,
M.L.Kraus,
C.N.Cronin,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 66.50 / 1.93 |
| Space group | P 1 21 1 |
| Cell size a, b, c (Å), α, β, γ (°) | 52.240, 48.551, 67.335, 90.00, 99.02, 90.00 |
| R / Rfree (%) | 17.7 / 22.4 |
Chlorine Binding Sites:
The binding sites of Chlorine atom in the Crystal Structure of Tyrosine-Protein Kinase Receptor in Complex with 2,4-Dichloro-N-(3-Methyl-1-Phenyl-1H-Pyrazol-5-Yl)Benzamide Inhibitor
(pdb code 6d1y). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Crystal Structure of Tyrosine-Protein Kinase Receptor in Complex with 2,4-Dichloro-N-(3-Methyl-1-Phenyl-1H-Pyrazol-5-Yl)Benzamide Inhibitor, PDB code: 6d1y:
Jump to Chlorine binding site number: 1; 2;
In total 2 binding sites of Chlorine where determined in the Crystal Structure of Tyrosine-Protein Kinase Receptor in Complex with 2,4-Dichloro-N-(3-Methyl-1-Phenyl-1H-Pyrazol-5-Yl)Benzamide Inhibitor, PDB code: 6d1y:
Jump to Chlorine binding site number: 1; 2;
Chlorine binding site 1 out of 2 in 6d1y
Go back to
Chlorine Binding Sites List in 6d1y
Chlorine binding site 1 out
of 2 in the Crystal Structure of Tyrosine-Protein Kinase Receptor in Complex with 2,4-Dichloro-N-(3-Methyl-1-Phenyl-1H-Pyrazol-5-Yl)Benzamide 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 Crystal Structure of Tyrosine-Protein Kinase Receptor in Complex with 2,4-Dichloro-N-(3-Methyl-1-Phenyl-1H-Pyrazol-5-Yl)Benzamide Inhibitor within 5.0Å range:
|
Chlorine binding site 2 out of 2 in 6d1y
Go back to
Chlorine Binding Sites List in 6d1y
Chlorine binding site 2 out
of 2 in the Crystal Structure of Tyrosine-Protein Kinase Receptor in Complex with 2,4-Dichloro-N-(3-Methyl-1-Phenyl-1H-Pyrazol-5-Yl)Benzamide 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 Crystal Structure of Tyrosine-Protein Kinase Receptor in Complex with 2,4-Dichloro-N-(3-Methyl-1-Phenyl-1H-Pyrazol-5-Yl)Benzamide Inhibitor within 5.0Å range:
|
Reference:
S.K.Bagal,
K.Omoto,
D.C.Blakemore,
P.J.Bungay,
J.G.Bilsland,
P.J.Clarke,
M.S.Corbett,
C.N.Cronin,
J.J.Cui,
R.Dias,
N.J.Flanagan,
S.E.Greasley,
R.Grimley,
E.Johnson,
D.Fengas,
L.Kitching,
M.L.Kraus,
I.Mcalpine,
A.Nagata,
G.J.Waldron,
J.S.Warmus.
Discovery of Allosteric, Potent, Subtype Selective, and Peripherally Restricted Trka Kinase Inhibitors. J. Med. Chem. V. 62 247 2019.
ISSN: ISSN 1520-4804
PubMed: 29672039
DOI: 10.1021/ACS.JMEDCHEM.8B00280
Page generated: Sat Jul 27 21:16:21 2024
ISSN: ISSN 1520-4804
PubMed: 29672039
DOI: 10.1021/ACS.JMEDCHEM.8B00280
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