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Fluorine in PDB 4kap: The Binding of Benzoarylsulfonamide Ligands to Human Carbonic Anhydrase Is Insensitive to Formal Fluorination of the Ligand
Enzymatic activity of The Binding of Benzoarylsulfonamide Ligands to Human Carbonic Anhydrase Is Insensitive to Formal Fluorination of the Ligand
All present enzymatic activity of The Binding of Benzoarylsulfonamide Ligands to Human Carbonic Anhydrase Is Insensitive to Formal Fluorination of the Ligand:
4.2.1.1;
4.2.1.1;
Protein crystallography data
The structure of The Binding of Benzoarylsulfonamide Ligands to Human Carbonic Anhydrase Is Insensitive to Formal Fluorination of the Ligand, PDB code: 4kap
was solved by
H.Lange,
M.R.Lockett,
B.Breiten,
A.Heroux,
W.Sherman,
D.Rappoport,
P.O.Yau,
P.W.Snyder,
G.M.Whitesides,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 35.78 / 1.45 |
| Space group | P 1 21 1 |
| Cell size a, b, c (Å), α, β, γ (°) | 42.527, 41.578, 72.593, 90.00, 104.62, 90.00 |
| R / Rfree (%) | 19.1 / 22.2 |
Other elements in 4kap:
The structure of The Binding of Benzoarylsulfonamide Ligands to Human Carbonic Anhydrase Is Insensitive to Formal Fluorination of the Ligand also contains other interesting chemical elements:
| Zinc | (Zn) | 1 atom |
Fluorine Binding Sites:
The binding sites of Fluorine atom in the The Binding of Benzoarylsulfonamide Ligands to Human Carbonic Anhydrase Is Insensitive to Formal Fluorination of the Ligand
(pdb code 4kap). This binding sites where shown within
5.0 Angstroms radius around Fluorine atom.
In total 4 binding sites of Fluorine where determined in the The Binding of Benzoarylsulfonamide Ligands to Human Carbonic Anhydrase Is Insensitive to Formal Fluorination of the Ligand, PDB code: 4kap:
Jump to Fluorine binding site number: 1; 2; 3; 4;
In total 4 binding sites of Fluorine where determined in the The Binding of Benzoarylsulfonamide Ligands to Human Carbonic Anhydrase Is Insensitive to Formal Fluorination of the Ligand, PDB code: 4kap:
Jump to Fluorine binding site number: 1; 2; 3; 4;
Fluorine binding site 1 out of 4 in 4kap
Go back to
Fluorine Binding Sites List in 4kap
Fluorine binding site 1 out
of 4 in the The Binding of Benzoarylsulfonamide Ligands to Human Carbonic Anhydrase Is Insensitive to Formal Fluorination of the Ligand
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 The Binding of Benzoarylsulfonamide Ligands to Human Carbonic Anhydrase Is Insensitive to Formal Fluorination of the Ligand within 5.0Å range:
|
Fluorine binding site 2 out of 4 in 4kap
Go back to
Fluorine Binding Sites List in 4kap
Fluorine binding site 2 out
of 4 in the The Binding of Benzoarylsulfonamide Ligands to Human Carbonic Anhydrase Is Insensitive to Formal Fluorination of the Ligand
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 The Binding of Benzoarylsulfonamide Ligands to Human Carbonic Anhydrase Is Insensitive to Formal Fluorination of the Ligand within 5.0Å range:
|
Fluorine binding site 3 out of 4 in 4kap
Go back to
Fluorine Binding Sites List in 4kap
Fluorine binding site 3 out
of 4 in the The Binding of Benzoarylsulfonamide Ligands to Human Carbonic Anhydrase Is Insensitive to Formal Fluorination of the Ligand
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 The Binding of Benzoarylsulfonamide Ligands to Human Carbonic Anhydrase Is Insensitive to Formal Fluorination of the Ligand within 5.0Å range:
|
Fluorine binding site 4 out of 4 in 4kap
Go back to
Fluorine Binding Sites List in 4kap
Fluorine binding site 4 out
of 4 in the The Binding of Benzoarylsulfonamide Ligands to Human Carbonic Anhydrase Is Insensitive to Formal Fluorination of the Ligand
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 4 of The Binding of Benzoarylsulfonamide Ligands to Human Carbonic Anhydrase Is Insensitive to Formal Fluorination of the Ligand within 5.0Å range:
|
Reference:
M.R.Lockett,
H.Lange,
B.Breiten,
A.Heroux,
W.Sherman,
D.Rappoport,
P.O.Yau,
P.W.Snyder,
G.M.Whitesides.
The Binding of Benzoarylsulfonamide Ligands to Human Carbonic Anhydrase Is Insensitive to Formal Fluorination of the Ligand. Angew.Chem.Int.Ed.Engl. V. 52 7714 2013.
ISSN: ISSN 1433-7851
PubMed: 23788494
DOI: 10.1002/ANIE.201301813
Page generated: Sun Dec 13 12:06:02 2020
ISSN: ISSN 1433-7851
PubMed: 23788494
DOI: 10.1002/ANIE.201301813
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