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Bromine in PDB 4d45: Crystal Structure of S. Aureus Fabi in Complex with Nadp and 5-Bromo-2-(4-Chloro-2-Hydroxyphenoxy)Benzonitrile
Enzymatic activity of Crystal Structure of S. Aureus Fabi in Complex with Nadp and 5-Bromo-2-(4-Chloro-2-Hydroxyphenoxy)Benzonitrile
All present enzymatic activity of Crystal Structure of S. Aureus Fabi in Complex with Nadp and 5-Bromo-2-(4-Chloro-2-Hydroxyphenoxy)Benzonitrile:
1.3.1.10; 1.3.1.39;
1.3.1.10; 1.3.1.39;
Protein crystallography data
The structure of Crystal Structure of S. Aureus Fabi in Complex with Nadp and 5-Bromo-2-(4-Chloro-2-Hydroxyphenoxy)Benzonitrile, PDB code: 4d45
was solved by
M.Tareilus,
J.Schiebel,
A.Chang,
P.J.Tonge,
C.A.Sotriffer,
C.Kisker,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 46.58 / 2.15 |
| Space group | P 1 |
| Cell size a, b, c (Å), α, β, γ (°) | 90.077, 95.168, 95.200, 98.43, 97.53, 111.47 |
| R / Rfree (%) | 17.417 / 22.679 |
Other elements in 4d45:
The structure of Crystal Structure of S. Aureus Fabi in Complex with Nadp and 5-Bromo-2-(4-Chloro-2-Hydroxyphenoxy)Benzonitrile also contains other interesting chemical elements:
| Chlorine | (Cl) | 8 atoms |
Bromine Binding Sites:
The binding sites of Bromine atom in the Crystal Structure of S. Aureus Fabi in Complex with Nadp and 5-Bromo-2-(4-Chloro-2-Hydroxyphenoxy)Benzonitrile
(pdb code 4d45). This binding sites where shown within
5.0 Angstroms radius around Bromine atom.
In total 8 binding sites of Bromine where determined in the Crystal Structure of S. Aureus Fabi in Complex with Nadp and 5-Bromo-2-(4-Chloro-2-Hydroxyphenoxy)Benzonitrile, PDB code: 4d45:
Jump to Bromine binding site number: 1; 2; 3; 4; 5; 6; 7; 8;
In total 8 binding sites of Bromine where determined in the Crystal Structure of S. Aureus Fabi in Complex with Nadp and 5-Bromo-2-(4-Chloro-2-Hydroxyphenoxy)Benzonitrile, PDB code: 4d45:
Jump to Bromine binding site number: 1; 2; 3; 4; 5; 6; 7; 8;
Bromine binding site 1 out of 8 in 4d45
Go back to
Bromine Binding Sites List in 4d45
Bromine binding site 1 out
of 8 in the Crystal Structure of S. Aureus Fabi in Complex with Nadp and 5-Bromo-2-(4-Chloro-2-Hydroxyphenoxy)Benzonitrile
Mono view
Stereo pair view
Mono view
Stereo pair view
A full contact list of Bromine with other atoms in the Br binding
site number 1 of Crystal Structure of S. Aureus Fabi in Complex with Nadp and 5-Bromo-2-(4-Chloro-2-Hydroxyphenoxy)Benzonitrile within 5.0Å range:
|
Bromine binding site 2 out of 8 in 4d45
Go back to
Bromine Binding Sites List in 4d45
Bromine binding site 2 out
of 8 in the Crystal Structure of S. Aureus Fabi in Complex with Nadp and 5-Bromo-2-(4-Chloro-2-Hydroxyphenoxy)Benzonitrile
Mono view
Stereo pair view
Mono view
Stereo pair view
A full contact list of Bromine with other atoms in the Br binding
site number 2 of Crystal Structure of S. Aureus Fabi in Complex with Nadp and 5-Bromo-2-(4-Chloro-2-Hydroxyphenoxy)Benzonitrile within 5.0Å range:
|
Bromine binding site 3 out of 8 in 4d45
Go back to
Bromine Binding Sites List in 4d45
Bromine binding site 3 out
of 8 in the Crystal Structure of S. Aureus Fabi in Complex with Nadp and 5-Bromo-2-(4-Chloro-2-Hydroxyphenoxy)Benzonitrile
Mono view
Stereo pair view
Mono view
Stereo pair view
A full contact list of Bromine with other atoms in the Br binding
site number 3 of Crystal Structure of S. Aureus Fabi in Complex with Nadp and 5-Bromo-2-(4-Chloro-2-Hydroxyphenoxy)Benzonitrile within 5.0Å range:
|
Bromine binding site 4 out of 8 in 4d45
Go back to
Bromine Binding Sites List in 4d45
Bromine binding site 4 out
of 8 in the Crystal Structure of S. Aureus Fabi in Complex with Nadp and 5-Bromo-2-(4-Chloro-2-Hydroxyphenoxy)Benzonitrile
Mono view
Stereo pair view
Mono view
Stereo pair view
A full contact list of Bromine with other atoms in the Br binding
site number 4 of Crystal Structure of S. Aureus Fabi in Complex with Nadp and 5-Bromo-2-(4-Chloro-2-Hydroxyphenoxy)Benzonitrile within 5.0Å range:
|
Bromine binding site 5 out of 8 in 4d45
Go back to
Bromine Binding Sites List in 4d45
Bromine binding site 5 out
of 8 in the Crystal Structure of S. Aureus Fabi in Complex with Nadp and 5-Bromo-2-(4-Chloro-2-Hydroxyphenoxy)Benzonitrile
Mono view
Stereo pair view
Mono view
Stereo pair view
A full contact list of Bromine with other atoms in the Br binding
site number 5 of Crystal Structure of S. Aureus Fabi in Complex with Nadp and 5-Bromo-2-(4-Chloro-2-Hydroxyphenoxy)Benzonitrile within 5.0Å range:
|
Bromine binding site 6 out of 8 in 4d45
Go back to
Bromine Binding Sites List in 4d45
Bromine binding site 6 out
of 8 in the Crystal Structure of S. Aureus Fabi in Complex with Nadp and 5-Bromo-2-(4-Chloro-2-Hydroxyphenoxy)Benzonitrile
Mono view
Stereo pair view
Mono view
Stereo pair view
A full contact list of Bromine with other atoms in the Br binding
site number 6 of Crystal Structure of S. Aureus Fabi in Complex with Nadp and 5-Bromo-2-(4-Chloro-2-Hydroxyphenoxy)Benzonitrile within 5.0Å range:
|
Bromine binding site 7 out of 8 in 4d45
Go back to
Bromine Binding Sites List in 4d45
Bromine binding site 7 out
of 8 in the Crystal Structure of S. Aureus Fabi in Complex with Nadp and 5-Bromo-2-(4-Chloro-2-Hydroxyphenoxy)Benzonitrile
Mono view
Stereo pair view
Mono view
Stereo pair view
A full contact list of Bromine with other atoms in the Br binding
site number 7 of Crystal Structure of S. Aureus Fabi in Complex with Nadp and 5-Bromo-2-(4-Chloro-2-Hydroxyphenoxy)Benzonitrile within 5.0Å range:
|
Bromine binding site 8 out of 8 in 4d45
Go back to
Bromine Binding Sites List in 4d45
Bromine binding site 8 out
of 8 in the Crystal Structure of S. Aureus Fabi in Complex with Nadp and 5-Bromo-2-(4-Chloro-2-Hydroxyphenoxy)Benzonitrile
Mono view
Stereo pair view
Mono view
Stereo pair view
A full contact list of Bromine with other atoms in the Br binding
site number 8 of Crystal Structure of S. Aureus Fabi in Complex with Nadp and 5-Bromo-2-(4-Chloro-2-Hydroxyphenoxy)Benzonitrile within 5.0Å range:
|
Reference:
J.Schiebel,
A.Chang,
B.Merget,
G.R.Bommineni,
W.Yu,
L.A.Spagnuolo,
M.V.Baxter,
M.Tareilus,
P.J.Tonge,
C.Kisker,
C.A.Sotriffer.
An Ordered Water Channel in Staphylococcus Aureus Fabi: Unraveling the Mechanism of Substrate Recognition and Reduction. Biochemistry 2015.
ISSN: ESSN 1520-4995
PubMed: 25706582
DOI: 10.1021/BI5014358
Page generated: Mon Jul 7 06:25:50 2025
ISSN: ESSN 1520-4995
PubMed: 25706582
DOI: 10.1021/BI5014358
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