Magnesium in PDB 1ye8: Crystal Structure of THEP1 From the Hyperthermophile Aquifex Aeolicus

The structure of Crystal Structure of THEP1 From the Hyperthermophile Aquifex Aeolicus, PDB code: 1ye8 was solved by M.Rossbach, O.Daumke, C.Klinger, A.Wittinghofer, M.Kaufmann, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	18.21 / 1.40
Space group	P 1 21 1
Cell size a, b, c (Å), α, β, γ (°)	35.870, 64.240, 39.620, 90.00, 105.23, 90.00
R / Rfree (%)	17.2 / 20.7

The structure of Crystal Structure of THEP1 From the Hyperthermophile Aquifex Aeolicus also contains other interesting chemical elements:

Sodium

(Na)

2 atoms

The binding sites of Magnesium atom in the Crystal Structure of THEP1 From the Hyperthermophile Aquifex Aeolicus (pdb code 1ye8). 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 THEP1 From the Hyperthermophile Aquifex Aeolicus, PDB code: 1ye8:

Magnesium binding site 1 out of 1 in the Crystal Structure of THEP1 From the Hyperthermophile Aquifex Aeolicus


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 THEP1 From the Hyperthermophile Aquifex Aeolicus within 5.0Å range: probe atom residue distance (Å) B Occ A:Mg1002 b:21.1 occ:1.00 O A:HOH1028 1.9 18.6 1.0 O A:HOH1252 2.0 17.6 0.5 O A:HOH1135 2.0 27.0 1.0 OG1 A:THR14 2.1 13.2 1.0 O1 A:PO41001 2.1 18.0 1.0 O A:HOH1227 2.4 19.9 1.0 O A:HOH1247 3.2 35.6 1.0 CB A:THR14 3.3 13.1 1.0 P A:PO41001 3.4 24.6 1.0 O A:HOH1252 3.4 26.4 0.5 O4 A:PO41001 3.6 26.5 1.0 N A:THR14 3.7 12.6 1.0 O A:HOH1170 3.7 30.2 1.0 O A:THR33 3.9 14.4 1.0 CA A:THR14 4.0 12.8 1.0 OD1 A:ASP106 4.0 12.5 1.0 OD2 A:ASP106 4.1 10.7 1.0 OE1 A:GLU107 4.3 19.6 1.0 NA A:NA1004 4.3 29.5 1.0 O3 A:PO41001 4.3 23.5 1.0 CG2 A:THR14 4.4 13.3 1.0 O2 A:PO41001 4.4 25.4 1.0 CG A:ASP106 4.6 10.1 1.0 O A:HOH1250 4.6 19.4 1.0 CB A:LYS13 4.7 12.6 1.0 C A:LYS13 4.8 11.9 1.0 O A:HOH1082 4.8 21.9 1.0

M.Rossbach, O.Daumke, C.Klinger, A.Wittinghofer, M.Kaufmann. Crystal Structure of THEP1 From the Hyperthermophile Aquifex Aeolicus: A Variation of the Reca Fold Bmc Struct.Biol. V. 5 7 2005.
ISSN: ESSN 1472-6807
PubMed: 15777481
DOI: 10.1186/1472-6807-5-7