Manganese in PDB 3t91: Structure of the Phosphatase Domain of the Cell Fate Determinant Spoiie From Bacillus Subtilis

All present enzymatic activity of Structure of the Phosphatase Domain of the Cell Fate Determinant Spoiie From Bacillus Subtilis:
3.1.3.16;

The structure of Structure of the Phosphatase Domain of the Cell Fate Determinant Spoiie From Bacillus Subtilis, PDB code: 3t91 was solved by V.M.Levdikov, E.V.Blagova, A.J.Wilkinson, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	10.00 / 2.64
Space group	P 61 2 2
Cell size a, b, c (Å), α, β, γ (°)	87.618, 87.618, 321.597, 90.00, 90.00, 120.00
R / Rfree (%)	22 / 27.9

The binding sites of Manganese atom in the Structure of the Phosphatase Domain of the Cell Fate Determinant Spoiie From Bacillus Subtilis (pdb code 3t91). This binding sites where shown within 5.0 Angstroms radius around Manganese atom.
In total 2 binding sites of Manganese where determined in the Structure of the Phosphatase Domain of the Cell Fate Determinant Spoiie From Bacillus Subtilis, PDB code: 3t91:
Jump to Manganese binding site number: 1; 2;

Manganese binding site 1 out of 2 in the Structure of the Phosphatase Domain of the Cell Fate Determinant Spoiie From Bacillus Subtilis


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 1 of Structure of the Phosphatase Domain of the Cell Fate Determinant Spoiie From Bacillus Subtilis within 5.0Å range: probe atom residue distance (Å) B Occ A:Mn1 b:89.8 occ:1.00 OD2 A:ASP746 2.0 72.4 1.0 OD1 A:ASP746 2.3 70.5 1.0 CG A:ASP746 2.5 61.1 1.0 OD2 B:ASP628 2.5 82.9 1.0 O A:HOH48 2.8 71.3 1.0 OD2 A:ASP795 2.8 81.7 1.0 OD1 A:ASP795 2.9 85.4 1.0 OD1 B:ASP628 2.9 77.2 1.0 CG B:ASP628 3.0 72.0 1.0 O A:HOH28 3.0 55.3 1.0 O B:HOH108 3.1 42.4 1.0 CG A:ASP795 3.2 76.9 1.0 CB A:ASP746 4.0 48.0 1.0 CB B:ASP628 4.2 65.6 1.0 OD1 B:ASP610 4.3 52.7 1.0 CB A:ASP795 4.5 66.9 1.0 O A:HOH33 4.6 54.3 1.0 O A:ASP796 4.7 52.8 1.0 N A:GLY747 4.7 43.4 1.0 CA A:ASP746 4.9 46.0 1.0 N A:ASP796 5.0 57.8 1.0 N A:ASP746 5.0 46.7 1.0

Manganese binding site 2 out of 2 in the Structure of the Phosphatase Domain of the Cell Fate Determinant Spoiie From Bacillus Subtilis


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 2 of Structure of the Phosphatase Domain of the Cell Fate Determinant Spoiie From Bacillus Subtilis within 5.0Å range: probe atom residue distance (Å) B Occ B:Mn3 b:0.7 occ:1.00 OD2 B:ASP746 1.8 0.5 1.0 OD1 B:ASP795 2.4 0.9 1.0 O B:HOH79 2.6 29.2 1.0 O A:HOH99 2.7 53.9 1.0 CG B:ASP746 2.9 0.3 1.0 OD1 A:ASP628 2.9 93.8 1.0 CG B:ASP795 3.3 0.5 1.0 OD2 B:ASP795 3.4 0.6 1.0 OD1 B:ASP746 3.5 0.5 1.0 CG A:ASP628 3.9 86.0 1.0 OD2 A:ASP628 4.0 87.4 1.0 CB B:ASP746 4.2 97.5 1.0 N B:GLY747 4.5 92.8 1.0 CB B:ASP795 4.7 0.7 1.0 O B:ASP796 4.7 0.9 1.0 N B:ASP796 4.8 1.0 1.0 OD1 A:ASP610 4.8 82.8 1.0

V.M.Levdikov, E.V.Blagova, A.E.Rawlings, K.Jameson, J.Tunaley, D.J.Hart, I.Barak, A.J.Wilkinson. Structure of the Phosphatase Domain of the Cell Fate Determinant Spoiie From Bacillus Subtilis. J.Mol.Biol. V. 415 343 2012.
ISSN: ISSN 0022-2836
PubMed: 22115775
DOI: 10.1016/J.JMB.2011.11.017