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Chlorine in PDB 4uio: Structure of the Salmonella Typhi Type I Dehydroquinase Covalently Inhibited By A 3-Dehydroquinic Acid Derivative
Enzymatic activity of Structure of the Salmonella Typhi Type I Dehydroquinase Covalently Inhibited By A 3-Dehydroquinic Acid Derivative
All present enzymatic activity of Structure of the Salmonella Typhi Type I Dehydroquinase Covalently Inhibited By A 3-Dehydroquinic Acid Derivative:
4.2.1.10;
4.2.1.10;
Protein crystallography data
The structure of Structure of the Salmonella Typhi Type I Dehydroquinase Covalently Inhibited By A 3-Dehydroquinic Acid Derivative, PDB code: 4uio
was solved by
J.M.Otero,
A.L.Llamas-Saiz,
L.Tizon,
E.Lence,
P.Thompson,
A.R.Hawkins,
C.Gonzalez-Bello,
M.J.Van Raaij,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 37.63 / 1.35 |
| Space group | I 1 2 1 |
| Cell size a, b, c (Å), α, β, γ (°) | 67.399, 42.327, 84.828, 90.00, 105.13, 90.00 |
| R / Rfree (%) | 17.4 / 21.4 |
Other elements in 4uio:
The structure of Structure of the Salmonella Typhi Type I Dehydroquinase Covalently Inhibited By A 3-Dehydroquinic Acid Derivative also contains other interesting chemical elements:
| Sodium | (Na) | 2 atoms |
Chlorine Binding Sites:
The binding sites of Chlorine atom in the Structure of the Salmonella Typhi Type I Dehydroquinase Covalently Inhibited By A 3-Dehydroquinic Acid Derivative
(pdb code 4uio). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Structure of the Salmonella Typhi Type I Dehydroquinase Covalently Inhibited By A 3-Dehydroquinic Acid Derivative, PDB code: 4uio:
Jump to Chlorine binding site number: 1; 2;
In total 2 binding sites of Chlorine where determined in the Structure of the Salmonella Typhi Type I Dehydroquinase Covalently Inhibited By A 3-Dehydroquinic Acid Derivative, PDB code: 4uio:
Jump to Chlorine binding site number: 1; 2;
Chlorine binding site 1 out of 2 in 4uio
Go back to
Chlorine Binding Sites List in 4uio
Chlorine binding site 1 out
of 2 in the Structure of the Salmonella Typhi Type I Dehydroquinase Covalently Inhibited By A 3-Dehydroquinic Acid Derivative
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 Structure of the Salmonella Typhi Type I Dehydroquinase Covalently Inhibited By A 3-Dehydroquinic Acid Derivative within 5.0Å range:
|
Chlorine binding site 2 out of 2 in 4uio
Go back to
Chlorine Binding Sites List in 4uio
Chlorine binding site 2 out
of 2 in the Structure of the Salmonella Typhi Type I Dehydroquinase Covalently Inhibited By A 3-Dehydroquinic Acid Derivative
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 Structure of the Salmonella Typhi Type I Dehydroquinase Covalently Inhibited By A 3-Dehydroquinic Acid Derivative within 5.0Å range:
|
Reference:
C.Gonzalez-Bello,
L.Tizon,
E.Lence,
J.M.Otero,
M.J.Van Raaij,
M.Martinez-Guitian,
A.Beceiro,
P.Thompson,
A.R.Hawkins.
Chemical Modification of A Dehydratase Enzyme Involved in Bacterial Virulence By An Ammonium Derivative: Evidence of Its Active Site Covalent Adduct. J.Am.Chem.Soc. V. 137 9333 2015.
ISSN: ISSN 0002-7863
PubMed: 26148116
DOI: 10.1021/JACS.5B04080
Page generated: Sat Dec 12 11:15:46 2020
ISSN: ISSN 0002-7863
PubMed: 26148116
DOI: 10.1021/JACS.5B04080
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