Magnesium in PDB 3vka: Crystal Structure of MOEO5 Soaked For 3 Hours in Fspp

The structure of Crystal Structure of MOEO5 Soaked For 3 Hours in Fspp, PDB code: 3vka was solved by F.Ren, T.-P.Ko, C.-H.Huang, R.-T.Guo, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	25.00 / 1.57
Space group	P 1
Cell size a, b, c (Å), α, β, γ (°)	46.598, 58.932, 58.765, 97.62, 108.44, 112.52
R / Rfree (%)	16.3 / 19.1

The binding sites of Magnesium atom in the Crystal Structure of MOEO5 Soaked For 3 Hours in Fspp (pdb code 3vka). 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 Crystal Structure of MOEO5 Soaked For 3 Hours in Fspp, PDB code: 3vka:

Magnesium binding site 1 out of 1 in the Crystal Structure of MOEO5 Soaked For 3 Hours in Fspp


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 1 of Crystal Structure of MOEO5 Soaked For 3 Hours in Fspp within 5.0Å range: probe atom residue distance (Å) B Occ A:Mg800 b:19.1 occ:1.00 O B:PHE140 2.4 22.4 1.0 O A:PHE140 2.5 20.4 1.0 O A:LEU137 2.5 15.2 1.0 O A:ALA138 2.6 18.6 1.0 O B:LEU137 2.6 14.7 1.0 O B:ALA138 2.6 19.1 1.0 C A:ALA138 3.1 16.2 1.0 C B:ALA138 3.3 16.7 1.0 CA A:ALA138 3.5 14.5 1.0 C B:PHE140 3.6 21.6 1.0 CA B:ALA138 3.6 16.0 1.0 C A:PHE140 3.6 19.3 1.0 C A:LEU137 3.6 15.0 1.0 C B:LEU137 3.7 14.8 1.0 O A:HOH383 3.8 35.6 1.0 N A:PHE140 3.8 17.8 1.0 N B:PHE140 3.9 17.2 1.0 O B:HOH362 3.9 29.8 1.0 N A:ALA138 4.1 14.8 1.0 N A:ALA139 4.1 17.3 1.0 N B:ALA138 4.1 14.9 1.0 CA A:PHE140 4.1 17.6 1.0 CA B:PHE140 4.2 17.9 1.0 CB A:PHE140 4.3 17.2 1.0 N B:ALA139 4.3 16.0 1.0 CD2 A:PHE140 4.3 19.7 1.0 CB B:PHE140 4.3 18.7 1.0 C A:ALA139 4.3 18.1 1.0 CD2 B:PHE140 4.3 22.9 1.0 C B:ALA139 4.4 19.5 1.0 N B:PRO141 4.6 24.4 1.0 CA A:ALA139 4.7 18.4 1.0 N A:PRO141 4.7 20.6 1.0 CA B:ALA139 4.8 17.7 1.0 CG A:PHE140 4.8 18.0 1.0 CD B:PRO141 4.8 24.8 1.0 CB A:ALA138 4.8 15.7 1.0 CG B:PHE140 4.8 21.7 1.0 O B:HOH488 4.9 39.8 1.0 CD A:PRO141 4.9 22.4 1.0 CA A:LEU137 5.0 14.8 1.0 CA B:LEU137 5.0 13.3 1.0 CB B:ALA138 5.0 15.8 1.0 O A:ALA139 5.0 20.5 1.0

F.Ren, T.-P.Ko, X.Feng, C.-H.Huang, H.-C.Chan, Y.Hu, K.Wang, Y.Ma, P.-H.Liang, A.H.-J.Wang, E.Oldfield, R.-T.Guo. Insights Into the Mechanism of the Antibiotic-Synthesizing Enzyme MOEO5 From Crystal Structures of Different Complexes Angew.Chem.Int.Ed.Engl. V. 51 4157 2012.
ISSN: ISSN 1433-7851
PubMed: 22431288
DOI: 10.1002/ANIE.201108002