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Fluorine in PDB 1eat: Nonpeptidic Inhibitors of Human Leukocyte Elastase. 5. Design, Synthesis, and X-Ray Crystallography of A Series of Orally Active 5- Amino-Pyrimidin-6-One-Containing Trifluoromethylketones
Enzymatic activity of Nonpeptidic Inhibitors of Human Leukocyte Elastase. 5. Design, Synthesis, and X-Ray Crystallography of A Series of Orally Active 5- Amino-Pyrimidin-6-One-Containing Trifluoromethylketones
All present enzymatic activity of Nonpeptidic Inhibitors of Human Leukocyte Elastase. 5. Design, Synthesis, and X-Ray Crystallography of A Series of Orally Active 5- Amino-Pyrimidin-6-One-Containing Trifluoromethylketones:
3.4.21.36;
3.4.21.36;
Protein crystallography data
The structure of Nonpeptidic Inhibitors of Human Leukocyte Elastase. 5. Design, Synthesis, and X-Ray Crystallography of A Series of Orally Active 5- Amino-Pyrimidin-6-One-Containing Trifluoromethylketones, PDB code: 1eat
was solved by
C.Ceccarelli,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 10.00 / 2.00 |
| Space group | P 21 21 21 |
| Cell size a, b, c (Å), α, β, γ (°) | 51.990, 57.790, 75.720, 90.00, 90.00, 90.00 |
| R / Rfree (%) | 16.7 / n/a |
Other elements in 1eat:
The structure of Nonpeptidic Inhibitors of Human Leukocyte Elastase. 5. Design, Synthesis, and X-Ray Crystallography of A Series of Orally Active 5- Amino-Pyrimidin-6-One-Containing Trifluoromethylketones also contains other interesting chemical elements:
| Sodium | (Na) | 1 atom |
Fluorine Binding Sites:
The binding sites of Fluorine atom in the Nonpeptidic Inhibitors of Human Leukocyte Elastase. 5. Design, Synthesis, and X-Ray Crystallography of A Series of Orally Active 5- Amino-Pyrimidin-6-One-Containing Trifluoromethylketones
(pdb code 1eat). This binding sites where shown within
5.0 Angstroms radius around Fluorine atom.
In total 3 binding sites of Fluorine where determined in the Nonpeptidic Inhibitors of Human Leukocyte Elastase. 5. Design, Synthesis, and X-Ray Crystallography of A Series of Orally Active 5- Amino-Pyrimidin-6-One-Containing Trifluoromethylketones, PDB code: 1eat:
Jump to Fluorine binding site number: 1; 2; 3;
In total 3 binding sites of Fluorine where determined in the Nonpeptidic Inhibitors of Human Leukocyte Elastase. 5. Design, Synthesis, and X-Ray Crystallography of A Series of Orally Active 5- Amino-Pyrimidin-6-One-Containing Trifluoromethylketones, PDB code: 1eat:
Jump to Fluorine binding site number: 1; 2; 3;
Fluorine binding site 1 out of 3 in 1eat
Go back to
Fluorine Binding Sites List in 1eat
Fluorine binding site 1 out
of 3 in the Nonpeptidic Inhibitors of Human Leukocyte Elastase. 5. Design, Synthesis, and X-Ray Crystallography of A Series of Orally Active 5- Amino-Pyrimidin-6-One-Containing Trifluoromethylketones
Mono view
Stereo pair view
Mono view
Stereo pair view
A full contact list of Fluorine with other atoms in the F binding
site number 1 of Nonpeptidic Inhibitors of Human Leukocyte Elastase. 5. Design, Synthesis, and X-Ray Crystallography of A Series of Orally Active 5- Amino-Pyrimidin-6-One-Containing Trifluoromethylketones within 5.0Å range:
|
Fluorine binding site 2 out of 3 in 1eat
Go back to
Fluorine Binding Sites List in 1eat
Fluorine binding site 2 out
of 3 in the Nonpeptidic Inhibitors of Human Leukocyte Elastase. 5. Design, Synthesis, and X-Ray Crystallography of A Series of Orally Active 5- Amino-Pyrimidin-6-One-Containing Trifluoromethylketones
Mono view
Stereo pair view
Mono view
Stereo pair view
A full contact list of Fluorine with other atoms in the F binding
site number 2 of Nonpeptidic Inhibitors of Human Leukocyte Elastase. 5. Design, Synthesis, and X-Ray Crystallography of A Series of Orally Active 5- Amino-Pyrimidin-6-One-Containing Trifluoromethylketones within 5.0Å range:
|
Fluorine binding site 3 out of 3 in 1eat
Go back to
Fluorine Binding Sites List in 1eat
Fluorine binding site 3 out
of 3 in the Nonpeptidic Inhibitors of Human Leukocyte Elastase. 5. Design, Synthesis, and X-Ray Crystallography of A Series of Orally Active 5- Amino-Pyrimidin-6-One-Containing Trifluoromethylketones
Mono view
Stereo pair view
Mono view
Stereo pair view
A full contact list of Fluorine with other atoms in the F binding
site number 3 of Nonpeptidic Inhibitors of Human Leukocyte Elastase. 5. Design, Synthesis, and X-Ray Crystallography of A Series of Orally Active 5- Amino-Pyrimidin-6-One-Containing Trifluoromethylketones within 5.0Å range:
|
Reference:
C.A.Veale,
P.R.Bernstein,
C.Bryant,
C.Ceccarelli,
J.R.Damewood Jr.,
R.Earley,
S.W.Feeney,
B.Gomes,
B.J.Kosmider,
G.B.Steelman,
R.M.Thomas,
E.P.Vacek,
J.C.Williams,
D.J.Wolanin,
S.Woolson.
Nonpeptidic Inhibitors of Human Leukocyte Elastase. 5. Design, Synthesis, and X-Ray Crystallography of A Series of Orally Active 5-Aminopyrimidin-6-One-Containing Trifluoromethyl Ketones. J.Med.Chem. V. 38 98 1995.
ISSN: ISSN 0022-2623
PubMed: 7837246
DOI: 10.1021/JM00001A015
Page generated: Sun Dec 13 11:29:13 2020
ISSN: ISSN 0022-2623
PubMed: 7837246
DOI: 10.1021/JM00001A015
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