Manganese in PDB 1lqo: Crystal Strutcure of the Fosfomycin Resistance Protein A (Fosa) Containing Bound Thallium Cations

All present enzymatic activity of Crystal Strutcure of the Fosfomycin Resistance Protein A (Fosa) Containing Bound Thallium Cations:
2.5.1.18;

The structure of Crystal Strutcure of the Fosfomycin Resistance Protein A (Fosa) Containing Bound Thallium Cations, PDB code: 1lqo was solved by C.L.Rife, R.E.Pharris, M.E.Newcomer, R.N.Armstrong, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	30.00 / 2.00
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	55.797, 65.874, 76.958, 90.00, 90.00, 90.00
R / Rfree (%)	19.7 / 25.2

The structure of Crystal Strutcure of the Fosfomycin Resistance Protein A (Fosa) Containing Bound Thallium Cations also contains other interesting chemical elements:

Thallium

(Tl)

6 atoms

The binding sites of Manganese atom in the Crystal Strutcure of the Fosfomycin Resistance Protein A (Fosa) Containing Bound Thallium Cations (pdb code 1lqo). 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 Strutcure of the Fosfomycin Resistance Protein A (Fosa) Containing Bound Thallium Cations, PDB code: 1lqo:
Jump to Manganese binding site number: 1; 2;

Manganese binding site 1 out of 2 in the Crystal Strutcure of the Fosfomycin Resistance Protein A (Fosa) Containing Bound Thallium Cations


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 1 of Crystal Strutcure of the Fosfomycin Resistance Protein A (Fosa) Containing Bound Thallium Cations within 5.0Å range: probe atom residue distance (Å) B Occ A:Mn402 b:26.5 occ:1.00 O3 A:PO4301 2.0 31.1 1.0 OE1 A:GLU110 2.1 19.8 1.0 O2 A:PO4302 2.1 30.0 1.0 NE2 A:HIS64 2.2 20.3 1.0 NE2 B:HIS7 2.3 22.8 1.0 P A:PO4301 2.8 37.3 1.0 O1 A:PO4301 3.1 41.2 1.0 CD A:GLU110 3.1 21.5 1.0 CE1 A:HIS64 3.1 22.0 1.0 P A:PO4302 3.2 36.5 1.0 O4 A:PO4302 3.2 42.9 1.0 CD2 A:HIS64 3.2 17.9 1.0 CE1 B:HIS7 3.3 19.7 1.0 CD2 B:HIS7 3.3 24.9 1.0 O2 A:PO4301 3.4 40.3 1.0 OE2 A:GLU110 3.4 21.2 1.0 TL B:TL601 3.8 28.4 0.5 OG1 B:THR9 4.0 19.4 1.0 O4 A:PO4301 4.0 35.3 1.0 O3 A:PO4302 4.2 42.5 1.0 O1 A:PO4302 4.3 43.5 1.0 ND1 A:HIS64 4.3 19.2 1.0 CG A:HIS64 4.4 21.1 1.0 CE2 A:TYR100 4.4 18.7 1.0 OH A:TYR62 4.4 53.0 1.0 ND1 B:HIS7 4.4 19.1 1.0 CG B:HIS7 4.5 19.5 1.0 CG A:GLU110 4.5 19.9 1.0 CB A:ALA66 4.6 18.9 1.0 OH A:TYR100 4.7 26.3 1.0 CB B:THR9 4.8 17.6 1.0 CB A:GLU110 4.9 19.0 1.0

Manganese binding site 2 out of 2 in the Crystal Strutcure of the Fosfomycin Resistance Protein A (Fosa) Containing Bound Thallium Cations


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 2 of Crystal Strutcure of the Fosfomycin Resistance Protein A (Fosa) Containing Bound Thallium Cations within 5.0Å range: probe atom residue distance (Å) B Occ B:Mn401 b:26.9 occ:1.00 OE1 B:GLU110 2.1 21.1 1.0 O4 A:PO4202 2.1 28.5 1.0 NE2 B:HIS64 2.2 21.4 1.0 O1 B:PO4201 2.2 39.8 1.0 NE2 A:HIS7 2.2 15.8 1.0 CE1 A:HIS7 3.1 19.8 1.0 CD B:GLU110 3.1 20.4 1.0 P B:PO4201 3.1 41.9 1.0 CE1 B:HIS64 3.1 24.0 1.0 CD2 B:HIS64 3.2 18.7 1.0 O4 B:PO4201 3.3 39.3 1.0 CD2 A:HIS7 3.3 19.3 1.0 P A:PO4202 3.4 32.2 1.0 OE2 B:GLU110 3.4 20.2 1.0 O2 A:PO4202 3.5 34.4 1.0 O3 B:PO4201 3.6 42.7 1.0 TL A:TL501 3.8 29.1 0.5 OG1 A:THR9 3.9 20.1 1.0 ND1 A:HIS7 4.3 18.9 1.0 ND1 B:HIS64 4.3 21.4 1.0 O1 A:PO4202 4.3 31.8 1.0 CG B:HIS64 4.3 21.3 1.0 CE2 B:TYR100 4.4 24.1 1.0 O3 A:PO4202 4.4 33.6 1.0 CG A:HIS7 4.4 19.6 1.0 CG B:GLU110 4.5 19.6 1.0 O2 B:PO4201 4.5 47.7 1.0 CB B:ALA66 4.7 20.0 1.0 OH B:TYR100 4.8 32.6 1.0 CB B:GLU110 4.9 17.7 1.0 CB A:THR9 5.0 20.0 1.0

C.L.Rife, R.E.Pharris, M.E.Newcomer, R.N.Armstrong. Crystal Structure of A Genomically Encoded Fosfomycin Resistance Protein (Fosa) at 1.19 A Resolution By Mad Phasing Off the L-III Edge of Tl(+) J.Am.Chem.Soc. V. 124 11001 2002.
ISSN: ISSN 0002-7863
PubMed: 12224946
DOI: 10.1021/JA026879V