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Chlorine in PDB 4a30: Crystal Structure of Leishmania Major N-Myristoyltransferase (Nmt) with Bound Myristoyl-Coa and A Pyrazole Sulphonamide Ligand
Enzymatic activity of Crystal Structure of Leishmania Major N-Myristoyltransferase (Nmt) with Bound Myristoyl-Coa and A Pyrazole Sulphonamide Ligand
All present enzymatic activity of Crystal Structure of Leishmania Major N-Myristoyltransferase (Nmt) with Bound Myristoyl-Coa and A Pyrazole Sulphonamide Ligand:
2.3.1.97;
2.3.1.97;
Protein crystallography data
The structure of Crystal Structure of Leishmania Major N-Myristoyltransferase (Nmt) with Bound Myristoyl-Coa and A Pyrazole Sulphonamide Ligand, PDB code: 4a30
was solved by
D.A.Robinson,
S.Brand,
A.H.Fairlamb,
M.A.J.Ferguson,
J.A.Frearson,
P.G.Wyatt,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
| Resolution Low / High (Å) | 19.95 / 1.50 |
| Space group | P 1 21 1 |
| Cell size a, b, c (Å), α, β, γ (°) | 48.636, 90.676, 53.514, 90.00, 114.02, 90.00 |
| R / Rfree (%) | 18.7 / 22.1 |
Other elements in 4a30:
The structure of Crystal Structure of Leishmania Major N-Myristoyltransferase (Nmt) with Bound Myristoyl-Coa and A Pyrazole Sulphonamide Ligand also contains other interesting chemical elements:
| Bromine | (Br) | 1 atom |
Chlorine Binding Sites:
The binding sites of Chlorine atom in the Crystal Structure of Leishmania Major N-Myristoyltransferase (Nmt) with Bound Myristoyl-Coa and A Pyrazole Sulphonamide Ligand
(pdb code 4a30). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total 3 binding sites of Chlorine where determined in the Crystal Structure of Leishmania Major N-Myristoyltransferase (Nmt) with Bound Myristoyl-Coa and A Pyrazole Sulphonamide Ligand, PDB code: 4a30:
Jump to Chlorine binding site number: 1; 2; 3;
In total 3 binding sites of Chlorine where determined in the Crystal Structure of Leishmania Major N-Myristoyltransferase (Nmt) with Bound Myristoyl-Coa and A Pyrazole Sulphonamide Ligand, PDB code: 4a30:
Jump to Chlorine binding site number: 1; 2; 3;
Chlorine binding site 1 out of 3 in 4a30
Go back to
Chlorine Binding Sites List in 4a30
Chlorine binding site 1 out
of 3 in the Crystal Structure of Leishmania Major N-Myristoyltransferase (Nmt) with Bound Myristoyl-Coa and A Pyrazole Sulphonamide Ligand
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 Leishmania Major N-Myristoyltransferase (Nmt) with Bound Myristoyl-Coa and A Pyrazole Sulphonamide Ligand within 5.0Å range:
|
Chlorine binding site 2 out of 3 in 4a30
Go back to
Chlorine Binding Sites List in 4a30
Chlorine binding site 2 out
of 3 in the Crystal Structure of Leishmania Major N-Myristoyltransferase (Nmt) with Bound Myristoyl-Coa and A Pyrazole Sulphonamide Ligand
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 Crystal Structure of Leishmania Major N-Myristoyltransferase (Nmt) with Bound Myristoyl-Coa and A Pyrazole Sulphonamide Ligand within 5.0Å range:
|
Chlorine binding site 3 out of 3 in 4a30
Go back to
Chlorine Binding Sites List in 4a30
Chlorine binding site 3 out
of 3 in the Crystal Structure of Leishmania Major N-Myristoyltransferase (Nmt) with Bound Myristoyl-Coa and A Pyrazole Sulphonamide Ligand
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 Crystal Structure of Leishmania Major N-Myristoyltransferase (Nmt) with Bound Myristoyl-Coa and A Pyrazole Sulphonamide Ligand within 5.0Å range:
|
Reference:
S.Brand,
L.A.Cleghorn,
S.P.Mcelroy,
D.A.Robinson,
V.C.Smith,
I.Hallyburton,
J.R.Harrison,
N.R.Norcross,
D.Spinks,
T.Bayliss,
S.Norval,
L.Stojanovski,
L.S.Torrie,
J.A.Frearson,
R.Brenk,
A.H.Fairlamb,
M.A.Ferguson,
K.D.Read,
P.G.Wyatt,
I.H.Gilbert.
Discovery of A Novel Class of Orally Active Trypanocidal N-Myristoyltransferase Inhibitors. J. Med. Chem. V. 55 140 2012.
ISSN: ISSN 1520-4804
PubMed: 22148754
DOI: 10.1021/JM201091T
Page generated: Sun Jul 21 08:52:15 2024
ISSN: ISSN 1520-4804
PubMed: 22148754
DOI: 10.1021/JM201091T
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