Bromine in PDB 4u9s: Crystal Structure of Nqrc From Vibrio Cholerae

The structure of Crystal Structure of Nqrc From Vibrio Cholerae, PDB code: 4u9s was solved by G.Fritz, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	45.36 / 1.70
Space group	P 1 21 1
Cell size a, b, c (Å), α, β, γ (°)	46.690, 41.730, 61.410, 90.00, 103.73, 90.00
R / Rfree (%)	18.6 / 20.6

The binding sites of Bromine atom in the Crystal Structure of Nqrc From Vibrio Cholerae (pdb code 4u9s). 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 Nqrc From Vibrio Cholerae, PDB code: 4u9s:

Bromine binding site 1 out of 1 in the Crystal Structure of Nqrc From Vibrio Cholerae


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 Nqrc From Vibrio Cholerae within 5.0Å range: probe atom residue distance (Å) B Occ C:Br303 b:30.7 occ:1.00 H C:ALA119 2.5 33.3 1.0 HE21 C:GLN93 2.6 32.8 1.0 HA C:ARG118 3.2 31.0 1.0 HB2 C:ALA97 3.2 32.7 1.0 HH2 C:TRP238 3.3 27.7 1.0 N C:ALA119 3.4 27.7 1.0 O C:HOH462 3.4 26.9 1.0 HG2 C:GLN93 3.4 33.2 1.0 O C:HOH470 3.4 26.7 1.0 NE2 C:GLN93 3.5 27.4 1.0 HB3 C:ALA119 3.5 31.4 1.0 HG2 C:ARG118 3.6 32.5 1.0 NE2 C:HIS141 3.7 26.9 1.0 HB2 C:ALA119 3.8 31.4 1.0 HZ2 C:TRP238 3.8 24.2 1.0 HB1 C:ALA97 3.8 32.7 1.0 HG3 C:ARG118 3.9 32.5 1.0 HE22 C:GLN93 3.9 32.8 1.0 CB C:ALA97 4.0 27.3 1.0 CB C:ALA119 4.0 26.1 1.0 CA C:ARG118 4.0 25.8 1.0 CH2 C:TRP238 4.1 23.1 1.0 CG C:ARG118 4.2 27.1 1.0 C C:ARG118 4.2 27.2 1.0 CG C:GLN93 4.2 27.6 1.0 HE2 C:PHE78 4.2 31.2 1.0 CA C:ALA119 4.3 28.2 1.0 HD12 C:ILE115 4.3 31.8 1.0 CZ2 C:TRP238 4.3 20.2 1.0 CD C:GLN93 4.3 27.4 1.0 HG3 C:GLN93 4.5 33.2 1.0 HB3 C:ALA97 4.5 32.7 1.0 HE1 C:HIS141 4.5 25.5 1.0 CE1 C:HIS141 4.6 21.3 1.0 O C:ARG117 4.6 25.9 1.0 CB C:ARG118 4.6 28.4 1.0 CD2 C:HIS141 4.7 24.0 1.0 HD2 C:HIS141 4.8 28.8 1.0 HA C:ALA97 4.8 32.7 1.0 O C:GLN93 4.8 28.1 1.0 O C:HOH468 4.8 28.1 1.0 HB1 C:ALA119 4.9 31.4 1.0 CE2 C:PHE78 5.0 26.0 1.0 HB2 C:ARG118 5.0 34.1 1.0 HA C:ALA119 5.0 33.8 1.0 HZ C:PHE78 5.0 32.1 1.0 O C:HOH467 5.0 28.2 1.0 CA C:ALA97 5.0 27.3 1.0

J.Steuber, G.Vohl, M.S.Casutt, T.Vorburger, K.Diederichs, G.Fritz. Structure of the V. Cholerae Na+-Pumping Nadh:Quinone Oxidoreductase Nature 2014.
ISSN: ESSN 1476-4687
DOI: 10.1038/NATURE14003