Magnesium in PDB 4aui: Structure and Function of the Porb Porin From Disseminating N. Gonorrhoeae

The structure of Structure and Function of the Porb Porin From Disseminating N. Gonorrhoeae, PDB code: 4aui was solved by K.Zeth, V.Kozjak-Pavlovic, M.Faulstich, R.Hurwitz, O.Kepp, T.Rudel, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	38.05 / 3.20
Space group	C 1 2 1
Cell size a, b, c (Å), α, β, γ (°)	114.050, 111.470, 88.340, 90.00, 102.07, 90.00
R / Rfree (%)	22.1 / 26.8

The binding sites of Magnesium atom in the Structure and Function of the Porb Porin From Disseminating N. Gonorrhoeae (pdb code 4aui). 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 Structure and Function of the Porb Porin From Disseminating N. Gonorrhoeae, PDB code: 4aui:

Magnesium binding site 1 out of 1 in the Structure and Function of the Porb Porin From Disseminating N. Gonorrhoeae


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 1 of Structure and Function of the Porb Porin From Disseminating N. Gonorrhoeae within 5.0Å range: probe atom residue distance (Å) B Occ A:Mg403 b:40.0 occ:1.00 OE1 A:GLU107 2.7 93.5 1.0 O1A A:ATP400 2.8 0.7 1.0 NZ A:LYS9 3.3 97.4 1.0 O3' A:ATP400 3.3 0.6 1.0 CD A:GLU107 3.5 92.5 1.0 OE2 A:GLU107 3.7 60.6 1.0 CE A:LYS9 3.9 57.0 1.0 PA A:ATP400 4.0 0.1 1.0 O5' A:ATP400 4.1 0.1 1.0 NZ A:LYS307 4.2 93.7 1.0 C3' A:ATP400 4.4 0.2 1.0 C4' A:ATP400 4.5 0.7 1.0 CD A:LYS9 4.5 49.0 1.0 O2' A:ATP400 4.5 0.3 1.0 CD A:ARG305 4.7 79.6 1.0 CG A:GLU107 4.9 0.0 1.0 C5' A:ATP400 4.9 0.2 1.0 CE A:LYS307 5.0 80.2 1.0 CG2 A:THR7 5.0 84.5 1.0

K.Zeth, V.Kozjak-Pavlovic, M.Faulstich, M.Fraunholz, R.Hurwitz, O.Kepp, T.Rudel. Structure and Function of the Porb Porin From Disseminating Neisseria Gonorrhoeae. Biochem.J. V. 449 631 2013.
ISSN: ISSN 0264-6021
PubMed: 23095086
DOI: 10.1042/BJ20121025