Bromine in PDB 7ocn: Crystal Structure of the Bifunctional Mannitol-1-Phosphate Dehydrogenase/Phosphatase Mtld From Acinetobacter Baumannii

The structure of Crystal Structure of the Bifunctional Mannitol-1-Phosphate Dehydrogenase/Phosphatase Mtld From Acinetobacter Baumannii, PDB code: 7ocn was solved by H.K.Tam, V.Mueller, K.M.Pos, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	48.52 / 2.60
Space group	C 2 2 21
Cell size a, b, c (Å), α, β, γ (°)	99.496, 157.418, 219.802, 90, 90, 90
R / Rfree (%)	23.7 / 26.7

The structure of Crystal Structure of the Bifunctional Mannitol-1-Phosphate Dehydrogenase/Phosphatase Mtld From Acinetobacter Baumannii also contains other interesting chemical elements:

Chlorine	(Cl)	4 atoms
Magnesium	(Mg)	3 atoms

The binding sites of Bromine atom in the Crystal Structure of the Bifunctional Mannitol-1-Phosphate Dehydrogenase/Phosphatase Mtld From Acinetobacter Baumannii (pdb code 7ocn). This binding sites where shown within 5.0 Angstroms radius around Bromine atom.
In total only one binding site of Bromine was determined in the Crystal Structure of the Bifunctional Mannitol-1-Phosphate Dehydrogenase/Phosphatase Mtld From Acinetobacter Baumannii, PDB code: 7ocn:

Bromine binding site 1 out of 1 in the Crystal Structure of the Bifunctional Mannitol-1-Phosphate Dehydrogenase/Phosphatase Mtld From Acinetobacter Baumannii


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 1 of Crystal Structure of the Bifunctional Mannitol-1-Phosphate Dehydrogenase/Phosphatase Mtld From Acinetobacter Baumannii within 5.0Å range: probe atom residue distance (Å) B Occ A:Br807 b:106.5 occ:1.00 N A:GLY99 3.2 61.3 1.0 NE2 A:GLN102 3.3 56.8 1.0 N A:GLN244 3.4 60.5 1.0 CA A:GLY99 3.6 59.8 1.0 CB A:ASN243 3.7 59.8 1.0 CG A:GLN102 3.9 56.5 1.0 CB A:GLN244 3.9 61.2 1.0 CA A:ASN243 4.0 60.4 1.0 CE1 A:TYR216 4.1 63.0 1.0 CD A:GLN102 4.1 56.4 1.0 CG A:GLN244 4.1 61.3 1.0 C A:LYS98 4.2 62.6 1.0 C A:ASN243 4.2 61.1 1.0 CG A:LYS98 4.2 66.5 1.0 CA A:GLN244 4.3 61.2 1.0 C A:GLY99 4.4 58.9 1.0 CA A:LYS98 4.4 64.2 1.0 CD A:GLN244 4.6 61.7 1.0 CD1 A:TYR216 4.7 63.2 1.0 CG A:ASN243 4.8 60.6 1.0 CB A:GLN102 4.8 56.0 1.0 N A:LEU100 4.9 58.6 1.0 CB A:LYS98 4.9 65.7 1.0 OE1 A:GLN244 5.0 62.5 1.0 O A:GLY99 5.0 58.0 1.0 C A:GLN244 5.0 61.2 1.0

H.K.Tam, P.Konig, S.Himpich, N.D.Ngu, R.Abele, V.Muller, K.M.Pos. Unidirectional Mannitol Synthesis of Acinetobacter Baumannii Mtld Is Facilitated By the Helix-Loop-Helix-Mediated Dimer Formation. Proc.Natl.Acad.Sci.Usa V. 119 94119 2022.
ISSN: ESSN 1091-6490
PubMed: 35363566
DOI: 10.1073/PNAS.2107994119