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Chlorine in PDB 9rf2: M. Tuberculosis Meets European Lead Factory: Identification and Structural Characterization of Novel RV0183 Inhibitors Using X-Ray Crystallography: ELF5

Enzymatic activity of M. Tuberculosis Meets European Lead Factory: Identification and Structural Characterization of Novel RV0183 Inhibitors Using X-Ray Crystallography: ELF5

All present enzymatic activity of M. Tuberculosis Meets European Lead Factory: Identification and Structural Characterization of Novel RV0183 Inhibitors Using X-Ray Crystallography: ELF5:
3.1.1.23;

Protein crystallography data

The structure of M. Tuberculosis Meets European Lead Factory: Identification and Structural Characterization of Novel RV0183 Inhibitors Using X-Ray Crystallography: ELF5, PDB code: 9rf2 was solved by L.Riegler-Berket, L.Goedl, M.Oberer, N.Polidori, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 41.39 / 1.60
Space group P 2 21 21
Cell size a, b, c (Å), α, β, γ (°) 40.411, 82.784, 90.704, 90, 90, 90
R / Rfree (%) 19 / 20.3

Chlorine Binding Sites:

The binding sites of Chlorine atom in the M. Tuberculosis Meets European Lead Factory: Identification and Structural Characterization of Novel RV0183 Inhibitors Using X-Ray Crystallography: ELF5 (pdb code 9rf2). 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 M. Tuberculosis Meets European Lead Factory: Identification and Structural Characterization of Novel RV0183 Inhibitors Using X-Ray Crystallography: ELF5, PDB code: 9rf2:

Chlorine binding site 1 out of 1 in 9rf2

Go back to Chlorine Binding Sites List in 9rf2
Chlorine binding site 1 out of 1 in the M. Tuberculosis Meets European Lead Factory: Identification and Structural Characterization of Novel RV0183 Inhibitors Using X-Ray Crystallography: ELF5


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of M. Tuberculosis Meets European Lead Factory: Identification and Structural Characterization of Novel RV0183 Inhibitors Using X-Ray Crystallography: ELF5 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl303

b:62.9
occ:1.00
NH2 A:ARG191 2.6 69.6 1.0
NE A:ARG191 3.0 73.3 1.0
CZ A:ARG191 3.3 69.4 1.0
N A:ARG191 3.5 33.9 1.0
CA A:GLY190 3.8 30.5 1.0
C A:GLY190 4.2 33.1 1.0
CB A:ARG191 4.2 40.2 1.0
CD A:ARG191 4.4 54.6 1.0
CA A:ARG191 4.4 33.4 1.0
CB A:PRO162 4.5 31.7 1.0
NH1 A:ARG191 4.6 68.0 1.0
CG A:ARG191 4.6 39.8 1.0
CG A:PRO162 4.8 39.8 1.0
O A:ARG191 5.0 30.2 1.0

Reference:

L.Riegler-Berket, L.Goedl, M.Oberer, N.Polidori. M. Tuberculosis Meets European Lead Factory: Identification and Structural Characterization of Novel RV0183 Inhibitors Using X-Ray Crystallography To Be Published.
Page generated: Sat Aug 23 00:46:53 2025

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