Manganese in PDB 3qvn: Crystal Structure of Cytosolic MNSOD3 From Candida Albicans

The structure of Crystal Structure of Cytosolic MNSOD3 From Candida Albicans, PDB code: 3qvn was solved by Y.Sheng, D.Cascio, J.S.Valentine, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	44.65 / 2.60
Space group	P 64 2 2
Cell size a, b, c (Å), α, β, γ (°)	77.134, 77.134, 120.080, 90.00, 90.00, 120.00
R / Rfree (%)	21.2 / 27.3

The binding sites of Manganese atom in the Crystal Structure of Cytosolic MNSOD3 From Candida Albicans (pdb code 3qvn). This binding sites where shown within 5.0 Angstroms radius around Manganese atom.
In total only one binding site of Manganese was determined in the Crystal Structure of Cytosolic MNSOD3 From Candida Albicans, PDB code: 3qvn:

Manganese binding site 1 out of 1 in the Crystal Structure of Cytosolic MNSOD3 From Candida Albicans


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 1 of Crystal Structure of Cytosolic MNSOD3 From Candida Albicans within 5.0Å range: probe atom residue distance (Å) B Occ A:Mn207 b:47.0 occ:1.00 NE2 A:HIS174 1.9 34.4 1.0 OD2 A:ASP170 2.1 42.2 1.0 NE2 A:HIS32 2.1 54.6 1.0 NE2 A:HIS80 2.3 36.2 1.0 O A:HOH216 2.3 40.0 1.0 CE1 A:HIS174 2.5 38.6 1.0 CE1 A:HIS32 3.0 54.2 1.0 CD2 A:HIS174 3.2 37.9 1.0 CG A:ASP170 3.2 42.8 1.0 CD2 A:HIS32 3.2 54.0 1.0 CD2 A:HIS80 3.2 39.0 1.0 CE1 A:HIS80 3.2 38.0 1.0 OD1 A:ASP170 3.6 44.1 1.0 ND1 A:HIS174 3.7 43.8 1.0 CG A:HIS174 4.1 40.8 1.0 ND1 A:HIS32 4.1 54.7 1.0 CG A:HIS32 4.3 54.8 1.0 CZ2 A:TRP134 4.3 38.6 1.0 ND1 A:HIS80 4.3 42.5 1.0 CG A:HIS80 4.3 38.4 1.0 CB A:TRP172 4.4 40.3 1.0 CB A:ASP170 4.5 37.0 1.0 CG A:TRP172 4.6 37.4 1.0 CH2 A:TRP134 4.7 44.1 1.0 CD1 A:TRP172 4.9 37.6 1.0 CB A:ALA175 4.9 35.0 1.0 NE2 A:GLN155 5.0 48.3 1.0

Y.Sheng, T.A.Stich, K.Barnese, E.B.Gralla, D.Cascio, R.D.Britt, D.E.Cabelli, J.S.Valentine. Comparison of Two Yeast Mnsods: Mitochondrial Saccharomyces Cerevisiae Versus Cytosolic Candida Albicans. J.Am.Chem.Soc. V. 133 20878 2011.
ISSN: ISSN 0002-7863
PubMed: 22077216
DOI: 10.1021/JA2077476