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Chlorine in PDB 4oyr: Competition of the Small Inhibitor PT91 with Large Fatty Acyl Substrate of the Mycobacterium Tuberculosis Enoyl-Acp Reductase Inha By Induced Substrate-Binding Loop Refolding
Enzymatic activity of Competition of the Small Inhibitor PT91 with Large Fatty Acyl Substrate of the Mycobacterium Tuberculosis Enoyl-Acp Reductase Inha By Induced Substrate-Binding Loop Refolding
All present enzymatic activity of Competition of the Small Inhibitor PT91 with Large Fatty Acyl Substrate of the Mycobacterium Tuberculosis Enoyl-Acp Reductase Inha By Induced Substrate-Binding Loop Refolding:
1.3.1.9;
1.3.1.9;
Protein crystallography data
The structure of Competition of the Small Inhibitor PT91 with Large Fatty Acyl Substrate of the Mycobacterium Tuberculosis Enoyl-Acp Reductase Inha By Induced Substrate-Binding Loop Refolding, PDB code: 4oyr
was solved by
H.J.Li,
P.Pan,
C.T.Lai,
N.Liu,
M.Garcia-Diaz,
C.Simmerling,
P.J.Tonge,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 43.70 / 2.30 |
| Space group | P 21 21 21 |
| Cell size a, b, c (Å), α, β, γ (°) | 74.842, 90.653, 164.436, 90.00, 90.00, 90.00 |
| R / Rfree (%) | 19.4 / 24.4 |
Chlorine Binding Sites:
The binding sites of Chlorine atom in the Competition of the Small Inhibitor PT91 with Large Fatty Acyl Substrate of the Mycobacterium Tuberculosis Enoyl-Acp Reductase Inha By Induced Substrate-Binding Loop Refolding
(pdb code 4oyr). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total 4 binding sites of Chlorine where determined in the Competition of the Small Inhibitor PT91 with Large Fatty Acyl Substrate of the Mycobacterium Tuberculosis Enoyl-Acp Reductase Inha By Induced Substrate-Binding Loop Refolding, PDB code: 4oyr:
Jump to Chlorine binding site number: 1; 2; 3; 4;
In total 4 binding sites of Chlorine where determined in the Competition of the Small Inhibitor PT91 with Large Fatty Acyl Substrate of the Mycobacterium Tuberculosis Enoyl-Acp Reductase Inha By Induced Substrate-Binding Loop Refolding, PDB code: 4oyr:
Jump to Chlorine binding site number: 1; 2; 3; 4;
Chlorine binding site 1 out of 4 in 4oyr
Go back to
Chlorine Binding Sites List in 4oyr
Chlorine binding site 1 out
of 4 in the Competition of the Small Inhibitor PT91 with Large Fatty Acyl Substrate of the Mycobacterium Tuberculosis Enoyl-Acp Reductase Inha By Induced Substrate-Binding Loop Refolding
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 Competition of the Small Inhibitor PT91 with Large Fatty Acyl Substrate of the Mycobacterium Tuberculosis Enoyl-Acp Reductase Inha By Induced Substrate-Binding Loop Refolding within 5.0Å range:
|
Chlorine binding site 2 out of 4 in 4oyr
Go back to
Chlorine Binding Sites List in 4oyr
Chlorine binding site 2 out
of 4 in the Competition of the Small Inhibitor PT91 with Large Fatty Acyl Substrate of the Mycobacterium Tuberculosis Enoyl-Acp Reductase Inha By Induced Substrate-Binding Loop Refolding
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 Competition of the Small Inhibitor PT91 with Large Fatty Acyl Substrate of the Mycobacterium Tuberculosis Enoyl-Acp Reductase Inha By Induced Substrate-Binding Loop Refolding within 5.0Å range:
|
Chlorine binding site 3 out of 4 in 4oyr
Go back to
Chlorine Binding Sites List in 4oyr
Chlorine binding site 3 out
of 4 in the Competition of the Small Inhibitor PT91 with Large Fatty Acyl Substrate of the Mycobacterium Tuberculosis Enoyl-Acp Reductase Inha By Induced Substrate-Binding Loop Refolding
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 3 of Competition of the Small Inhibitor PT91 with Large Fatty Acyl Substrate of the Mycobacterium Tuberculosis Enoyl-Acp Reductase Inha By Induced Substrate-Binding Loop Refolding within 5.0Å range:
|
Chlorine binding site 4 out of 4 in 4oyr
Go back to
Chlorine Binding Sites List in 4oyr
Chlorine binding site 4 out
of 4 in the Competition of the Small Inhibitor PT91 with Large Fatty Acyl Substrate of the Mycobacterium Tuberculosis Enoyl-Acp Reductase Inha By Induced Substrate-Binding Loop Refolding
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 4 of Competition of the Small Inhibitor PT91 with Large Fatty Acyl Substrate of the Mycobacterium Tuberculosis Enoyl-Acp Reductase Inha By Induced Substrate-Binding Loop Refolding within 5.0Å range:
|
Reference:
H.J.Li,
C.T.Lai,
P.Pan,
W.Yu,
N.Liu,
G.R.Bommineni,
M.Garcia-Diaz,
C.Simmerling,
P.J.Tonge.
A Structural and Energetic Model For the Slow-Onset Inhibition of the Mycobacterium Tuberculosis Enoyl-Acp Reductase Inha. Acs Chem.Biol. V. 9 986 2014.
ISSN: ESSN 1554-8937
PubMed: 24527857
DOI: 10.1021/CB400896G
Page generated: Thu Jul 25 23:42:06 2024
ISSN: ESSN 1554-8937
PubMed: 24527857
DOI: 10.1021/CB400896G
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