Manganese in PDB 3mds: Maganese Superoxide Dismutase From Thermus Thermophilus

All present enzymatic activity of Maganese Superoxide Dismutase From Thermus Thermophilus:
1.15.1.1;

The structure of Maganese Superoxide Dismutase From Thermus Thermophilus, PDB code: 3mds was solved by M.L.Ludwig, A.L.Metzger, K.A.Pattridge, W.C.Stallings, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	20.00 / 1.80
Space group	P 41 21 2
Cell size a, b, c (Å), α, β, γ (°)	146.600, 146.600, 55.600, 90.00, 90.00, 90.00
R / Rfree (%)	n/a / n/a

The binding sites of Manganese atom in the Maganese Superoxide Dismutase From Thermus Thermophilus (pdb code 3mds). This binding sites where shown within 5.0 Angstroms radius around Manganese atom.
In total 2 binding sites of Manganese where determined in the Maganese Superoxide Dismutase From Thermus Thermophilus, PDB code: 3mds:
Jump to Manganese binding site number: 1; 2;

Manganese binding site 1 out of 2 in the Maganese Superoxide Dismutase From Thermus Thermophilus


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 1 of Maganese Superoxide Dismutase From Thermus Thermophilus within 5.0Å range: probe atom residue distance (Å) B Occ A:Mn204 b:7.2 occ:0.97 OD2 A:ASP166 1.8 5.1 1.0 O A:HOH205 2.1 6.1 1.0 NE2 A:HIS83 2.1 7.7 1.0 NE2 A:HIS28 2.1 5.9 1.0 NE2 A:HIS170 2.2 7.0 1.0 CG A:ASP166 3.0 6.1 1.0 CE1 A:HIS83 3.1 8.6 1.0 CE1 A:HIS28 3.1 6.4 1.0 CD2 A:HIS170 3.1 7.3 1.0 CD2 A:HIS83 3.1 8.5 1.0 CD2 A:HIS28 3.1 6.1 1.0 CE1 A:HIS170 3.1 6.3 1.0 OD1 A:ASP166 3.4 8.2 1.0 ND1 A:HIS83 4.2 7.8 1.0 ND1 A:HIS28 4.2 5.8 1.0 CZ2 A:TRP132 4.3 6.8 1.0 ND1 A:HIS170 4.3 7.5 1.0 CG A:HIS83 4.3 9.1 1.0 CB A:ASP166 4.3 6.8 1.0 CG A:HIS28 4.3 5.3 1.0 CG A:HIS170 4.3 7.1 1.0 CB A:TRP168 4.6 5.9 1.0 NE2 A:GLN151 4.6 5.8 1.0 CG A:TRP168 4.8 5.2 1.0 CB A:ALA171 4.9 6.7 1.0 CE2 A:TRP132 5.0 7.1 1.0 CH2 A:TRP132 5.0 6.5 1.0

Manganese binding site 2 out of 2 in the Maganese Superoxide Dismutase From Thermus Thermophilus


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 2 of Maganese Superoxide Dismutase From Thermus Thermophilus within 5.0Å range: probe atom residue distance (Å) B Occ B:Mn204 b:7.2 occ:0.97 OD2 B:ASP166 1.8 6.6 1.0 NE2 B:HIS83 2.1 7.1 1.0 O B:HOH205 2.1 6.5 1.0 NE2 B:HIS28 2.1 6.2 1.0 NE2 B:HIS170 2.2 7.1 1.0 CG B:ASP166 2.9 7.2 1.0 CE1 B:HIS83 3.0 7.3 1.0 CE1 B:HIS28 3.1 6.8 1.0 CD2 B:HIS28 3.1 6.9 1.0 CD2 B:HIS83 3.1 7.1 1.0 CD2 B:HIS170 3.2 6.4 1.0 CE1 B:HIS170 3.2 6.2 1.0 OD1 B:ASP166 3.4 8.8 1.0 ND1 B:HIS83 4.2 7.9 1.0 ND1 B:HIS28 4.2 8.7 1.0 CZ2 B:TRP132 4.2 6.6 1.0 CB B:ASP166 4.2 8.3 1.0 CG B:HIS28 4.3 7.0 1.0 CG B:HIS83 4.3 7.3 1.0 ND1 B:HIS170 4.3 6.9 1.0 CG B:HIS170 4.3 6.8 1.0 NE2 B:GLN151 4.6 8.3 1.0 CB B:TRP168 4.7 6.5 1.0 CG B:TRP168 4.8 6.2 1.0 CH2 B:TRP132 4.9 5.8 1.0 CE2 B:TRP132 5.0 6.4 1.0 CB B:ALA171 5.0 8.4 1.0

M.L.Ludwig, A.L.Metzger, K.A.Pattridge, W.C.Stallings. Manganese Superoxide Dismutase From Thermus Thermophilus. A Structural Model Refined at 1.8 A Resolution. J.Mol.Biol. V. 219 335 1991.
ISSN: ISSN 0022-2836
PubMed: 2038060
DOI: 10.1016/0022-2836(91)90569-R