Manganese in PDB 3w42: Crystal Structure of Rsbx in Complex with Manganese in Space Group P1

All present enzymatic activity of Crystal Structure of Rsbx in Complex with Manganese in Space Group P1:
3.1.3.3;

The structure of Crystal Structure of Rsbx in Complex with Manganese in Space Group P1, PDB code: 3w42 was solved by A.H.Teh, M.Makino, S.Baba, N.Shimizu, M.Yamamoto, T.Kumasaka, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	20.00 / 1.06
Space group	P 1
Cell size a, b, c (Å), α, β, γ (°)	33.198, 41.649, 68.755, 81.17, 89.96, 71.46
R / Rfree (%)	12.7 / 15.5

The binding sites of Manganese atom in the Crystal Structure of Rsbx in Complex with Manganese in Space Group P1 (pdb code 3w42). This binding sites where shown within 5.0 Angstroms radius around Manganese atom.
In total 2 binding sites of Manganese where determined in the Crystal Structure of Rsbx in Complex with Manganese in Space Group P1, PDB code: 3w42:
Jump to Manganese binding site number: 1; 2;

Manganese binding site 1 out of 2 in the Crystal Structure of Rsbx in Complex with Manganese in Space Group P1


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 Rsbx in Complex with Manganese in Space Group P1 within 5.0Å range: probe atom residue distance (Å) B Occ A:Mn201 b:5.2 occ:0.48 OD1 A:ASP156 2.0 5.3 1.0 O A:HOH356 2.1 5.3 1.0 O A:HOH354 2.1 6.1 1.0 OD2 A:ASP44 2.1 5.2 1.0 OD2 A:ASP189 2.1 6.7 1.0 O A:HOH355 2.1 6.2 1.0 CG A:ASP156 3.0 5.0 1.0 CG A:ASP44 3.1 5.2 1.0 CG A:ASP189 3.1 6.3 1.0 OD2 A:ASP156 3.4 6.0 1.0 OD1 A:ASP44 3.5 5.6 1.0 OD1 A:ASP189 3.5 6.9 1.0 NZ B:LYS147 3.9 6.1 1.0 O A:HOH449 4.0 10.5 1.0 O A:HOH359 4.0 8.6 1.0 O A:HOH362 4.0 5.7 1.0 OD1 A:ASP27 4.1 5.3 1.0 O A:HOH357 4.2 5.8 1.0 N A:GLY157 4.3 5.8 1.0 O A:ASP190 4.3 5.4 1.0 CB A:ASP156 4.4 5.5 1.0 CB A:ASP44 4.4 5.2 1.0 CB A:ASP189 4.4 7.8 1.0 N A:ASP156 4.5 5.4 1.0 C A:ASP156 4.7 6.3 1.0 CE B:LYS147 4.7 6.6 1.0 CA A:ASP156 4.7 5.9 1.0 CB A:THR155 4.9 4.8 1.0 O A:HOH467 4.9 13.9 1.0 CA A:GLY157 5.0 6.1 1.0

Manganese binding site 2 out of 2 in the Crystal Structure of Rsbx in Complex with Manganese in Space Group P1


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 2 of Crystal Structure of Rsbx in Complex with Manganese in Space Group P1 within 5.0Å range: probe atom residue distance (Å) B Occ B:Mn201 b:5.9 occ:0.50 OD1 B:ASP156 2.0 5.4 1.0 O B:HOH351 2.1 5.3 1.0 OD2 B:ASP44 2.1 5.8 1.0 O B:HOH349 2.1 6.5 1.0 O B:HOH350 2.1 6.0 1.0 OD2 B:ASP189 2.1 6.7 1.0 CG B:ASP156 3.0 4.9 1.0 CG B:ASP44 3.1 5.5 1.0 CG B:ASP189 3.1 6.8 1.0 OD2 B:ASP156 3.4 6.3 1.0 OD1 B:ASP189 3.5 7.1 1.0 OD1 B:ASP44 3.5 6.0 1.0 O B:HOH355 4.0 5.6 1.0 O B:HOH368 4.0 9.9 1.0 O B:HOH356 4.0 8.6 1.0 OD1 B:ASP27 4.1 5.3 1.0 O B:HOH352 4.1 6.4 1.0 N B:GLY157 4.3 5.8 1.0 O B:ASP190 4.3 5.7 1.0 CB B:ASP156 4.4 6.2 1.0 CB B:ASP44 4.4 5.0 1.0 CB B:ASP189 4.4 8.3 1.0 N B:ASP156 4.5 5.2 1.0 C B:ASP156 4.7 5.4 1.0 CA B:ASP156 4.7 6.1 1.0 CB B:THR155 4.9 4.9 1.0 O B:HOH436 4.9 14.0 1.0 CA B:GLY157 5.0 6.4 1.0

M.Makino, A.H.Teh, T.Hoshino, S.Baba, N.Shimizu, M.Yamamoto, T.Kumasaka. Structural Basis For Di-Metal Coordination and Negative Feedback in General Stress Response By Rsbx Phosphatase From Bacillus Subtilis To Be Published.