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Chlorine in PDB 4u0k: Crystal Structure of Mycobacterium Tuberculosis Enoyl Reductase Complexed with N-(5-Chloro-2-Methylphenyl)-1-Cyclohexyl-5- Oxopyrrolidine-3-Carboxamide
Enzymatic activity of Crystal Structure of Mycobacterium Tuberculosis Enoyl Reductase Complexed with N-(5-Chloro-2-Methylphenyl)-1-Cyclohexyl-5- Oxopyrrolidine-3-Carboxamide
All present enzymatic activity of Crystal Structure of Mycobacterium Tuberculosis Enoyl Reductase Complexed with N-(5-Chloro-2-Methylphenyl)-1-Cyclohexyl-5- Oxopyrrolidine-3-Carboxamide:
1.3.1.9;
1.3.1.9;
Protein crystallography data
The structure of Crystal Structure of Mycobacterium Tuberculosis Enoyl Reductase Complexed with N-(5-Chloro-2-Methylphenyl)-1-Cyclohexyl-5- Oxopyrrolidine-3-Carboxamide, PDB code: 4u0k
was solved by
X.He,
A.Alian,
R.M.Stroud,
P.R.Ortiz De Montellano,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 40.89 / 1.90 |
| Space group | P 62 2 2 |
| Cell size a, b, c (Å), α, β, γ (°) | 97.057, 97.057, 140.421, 90.00, 90.00, 120.00 |
| R / Rfree (%) | 14.4 / 17.3 |
Chlorine Binding Sites:
The binding sites of Chlorine atom in the Crystal Structure of Mycobacterium Tuberculosis Enoyl Reductase Complexed with N-(5-Chloro-2-Methylphenyl)-1-Cyclohexyl-5- Oxopyrrolidine-3-Carboxamide
(pdb code 4u0k). 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 Crystal Structure of Mycobacterium Tuberculosis Enoyl Reductase Complexed with N-(5-Chloro-2-Methylphenyl)-1-Cyclohexyl-5- Oxopyrrolidine-3-Carboxamide, PDB code: 4u0k:
In total only one binding site of Chlorine was determined in the Crystal Structure of Mycobacterium Tuberculosis Enoyl Reductase Complexed with N-(5-Chloro-2-Methylphenyl)-1-Cyclohexyl-5- Oxopyrrolidine-3-Carboxamide, PDB code: 4u0k:
Chlorine binding site 1 out of 1 in 4u0k
Go back to
Chlorine Binding Sites List in 4u0k
Chlorine binding site 1 out
of 1 in the Crystal Structure of Mycobacterium Tuberculosis Enoyl Reductase Complexed with N-(5-Chloro-2-Methylphenyl)-1-Cyclohexyl-5- Oxopyrrolidine-3-Carboxamide
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 Crystal Structure of Mycobacterium Tuberculosis Enoyl Reductase Complexed with N-(5-Chloro-2-Methylphenyl)-1-Cyclohexyl-5- Oxopyrrolidine-3-Carboxamide within 5.0Å range:
|
Reference:
X.He,
A.Alian,
R.M.Stroud,
P.R.Ortiz De Montellano.
Pyrrolidine Carboxamides As A Novel Class of Inhibitors of Enoyl Acyl Carrier Protein Reductase From Mycobacterium Tuberculosis J. Med. Chem. 6308 2006.
PubMed: 17034137
DOI: 10.1021/JM060715Y
Page generated: Fri Jul 26 02:02:05 2024
PubMed: 17034137
DOI: 10.1021/JM060715Y
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