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Chlorine in PDB 5i7h: Mycobacterium Tuberculosis Cysm in Complex with the Urea-Scaffold Inhibitor 6 [3-(3-(4-Bromophenyl)Ureido)Benzoic Acid]
Enzymatic activity of Mycobacterium Tuberculosis Cysm in Complex with the Urea-Scaffold Inhibitor 6 [3-(3-(4-Bromophenyl)Ureido)Benzoic Acid]
All present enzymatic activity of Mycobacterium Tuberculosis Cysm in Complex with the Urea-Scaffold Inhibitor 6 [3-(3-(4-Bromophenyl)Ureido)Benzoic Acid]:
2.5.1.113;
2.5.1.113;
Protein crystallography data
The structure of Mycobacterium Tuberculosis Cysm in Complex with the Urea-Scaffold Inhibitor 6 [3-(3-(4-Bromophenyl)Ureido)Benzoic Acid], PDB code: 5i7h
was solved by
R.Schnell,
S.Maric,
G.Schneider,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 75.25 / 2.57 |
| Space group | P 1 |
| Cell size a, b, c (Å), α, β, γ (°) | 64.591, 76.089, 80.716, 94.33, 108.32, 107.66 |
| R / Rfree (%) | 20.1 / 26.5 |
Other elements in 5i7h:
The structure of Mycobacterium Tuberculosis Cysm in Complex with the Urea-Scaffold Inhibitor 6 [3-(3-(4-Bromophenyl)Ureido)Benzoic Acid] also contains other interesting chemical elements:
| Bromine | (Br) | 4 atoms |
Chlorine Binding Sites:
The binding sites of Chlorine atom in the Mycobacterium Tuberculosis Cysm in Complex with the Urea-Scaffold Inhibitor 6 [3-(3-(4-Bromophenyl)Ureido)Benzoic Acid]
(pdb code 5i7h). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total only one binding site of Chlorine was determined in the Mycobacterium Tuberculosis Cysm in Complex with the Urea-Scaffold Inhibitor 6 [3-(3-(4-Bromophenyl)Ureido)Benzoic Acid], PDB code: 5i7h:
In total only one binding site of Chlorine was determined in the Mycobacterium Tuberculosis Cysm in Complex with the Urea-Scaffold Inhibitor 6 [3-(3-(4-Bromophenyl)Ureido)Benzoic Acid], PDB code: 5i7h:
Chlorine binding site 1 out of 1 in 5i7h
Go back to
Chlorine Binding Sites List in 5i7h
Chlorine binding site 1 out
of 1 in the Mycobacterium Tuberculosis Cysm in Complex with the Urea-Scaffold Inhibitor 6 [3-(3-(4-Bromophenyl)Ureido)Benzoic Acid]
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 Mycobacterium Tuberculosis Cysm in Complex with the Urea-Scaffold Inhibitor 6 [3-(3-(4-Bromophenyl)Ureido)Benzoic Acid] within 5.0Å range:
|
Reference:
K.Brunner,
S.Maric,
R.S.Reshma,
H.Almqvist,
B.Seashore-Ludlow,
A.L.Gustavsson,
O.Poyraz,
P.Yogeeswari,
T.Lundback,
M.Vallin,
D.Sriram,
R.Schnell,
G.Schneider.
Inhibitors of the Cysteine Synthase Cysm with Antibacterial Potency Against Dormant Mycobacterium Tuberculosis. J.Med.Chem. V. 59 6848 2016.
ISSN: ISSN 0022-2623
PubMed: 27379713
DOI: 10.1021/ACS.JMEDCHEM.6B00674
Page generated: Fri Jul 26 09:12:42 2024
ISSN: ISSN 0022-2623
PubMed: 27379713
DOI: 10.1021/ACS.JMEDCHEM.6B00674
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