Magnesium in PDB 2yoo: Cholest-4-En-3-One Bound Structure of CYP142 From Mycobacterium Smegmatis

The structure of Cholest-4-En-3-One Bound Structure of CYP142 From Mycobacterium Smegmatis, PDB code: 2yoo was solved by E.Garcia-Fernandez, D.J.Frank, B.Galan, P.M.Kells, L.M.Podust, J.L.Garcia, P.R.Ortiz De Montellano, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	126.53 / 1.69
Space group	P 1 21 1
Cell size a, b, c (Å), α, β, γ (°)	56.683, 106.213, 126.536, 90.00, 90.67, 90.00
R / Rfree (%)	16.5 / 21.9

The structure of Cholest-4-En-3-One Bound Structure of CYP142 From Mycobacterium Smegmatis also contains other interesting chemical elements:

Iron

(Fe)

4 atoms

The binding sites of Magnesium atom in the Cholest-4-En-3-One Bound Structure of CYP142 From Mycobacterium Smegmatis (pdb code 2yoo). This binding sites where shown within 5.0 Angstroms radius around Magnesium atom.
In total only one binding site of Magnesium was determined in the Cholest-4-En-3-One Bound Structure of CYP142 From Mycobacterium Smegmatis, PDB code: 2yoo:

Magnesium binding site 1 out of 1 in the Cholest-4-En-3-One Bound Structure of CYP142 From Mycobacterium Smegmatis


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 1 of Cholest-4-En-3-One Bound Structure of CYP142 From Mycobacterium Smegmatis within 5.0Å range: probe atom residue distance (Å) B Occ B:Mg1405 b:21.3 occ:1.00 O B:HOH2459 2.0 26.4 1.0 O B:HOH2119 2.1 17.4 1.0 O B:HOH2457 2.2 15.7 1.0 O B:HOH2456 2.2 18.8 1.0 O B:HOH2458 2.2 20.9 1.0 O B:HOH2151 2.3 16.3 1.0 O B:HOH2116 4.0 12.5 1.0 OD2 B:ASP82 4.1 9.4 1.0 O B:HOH2160 4.5 40.7 1.0 OG B:SER63 4.5 9.8 1.0 OG1 B:THR65 5.0 9.8 1.0 CG2 B:THR288 5.0 9.1 1.0

E.Garcia-Fernandez, D.J.Frank, B.Galan, P.M.Kells, L.M.Podust, J.L.Garcia, P.R.Ortiz De Montellano. A Highly Conserved Mycobacterial Cholesterol Catabolic Pathway. Environ.Microbiol. V. 15 2342 2013.
ISSN: ISSN 1462-2912
PubMed: 23489718
DOI: 10.1111/1462-2920.12108