Bromine in PDB 8tg1: Caldicellulosiruptor Saccharolyticus Periplasmic Urea-Binding Protein

The structure of Caldicellulosiruptor Saccharolyticus Periplasmic Urea-Binding Protein, PDB code: 8tg1 was solved by M.J.Allert, S.Kumar, Y.Wang, L.S.Beese, H.W.Hellinga, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	45.83 / 2.10
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	79.235, 91.67, 96.546, 90, 90, 90
R / Rfree (%)	18.1 / 23.6

The binding sites of Bromine atom in the Caldicellulosiruptor Saccharolyticus Periplasmic Urea-Binding Protein (pdb code 8tg1). 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 Caldicellulosiruptor Saccharolyticus Periplasmic Urea-Binding Protein, PDB code: 8tg1:

Bromine binding site 1 out of 1 in the Caldicellulosiruptor Saccharolyticus Periplasmic Urea-Binding Protein


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 1 of Caldicellulosiruptor Saccharolyticus Periplasmic Urea-Binding Protein within 5.0Å range: probe atom residue distance (Å) B Occ A:Br402 b:19.1 occ:1.00 NZ B:LYS36 3.2 17.9 1.0 NZ A:LYS36 3.3 11.6 1.0 CG1 A:VAL33 3.8 12.8 1.0 CD2 B:LEU24 3.9 12.5 1.0 CE B:LYS36 3.9 19.4 1.0 CB A:LEU24 3.9 8.5 1.0 CD2 A:LEU24 4.0 13.2 1.0 CB B:LEU24 4.0 11.8 1.0 CD1 B:LEU24 4.0 9.5 1.0 CE A:LYS36 4.0 16.8 1.0 CG1 B:VAL33 4.1 13.1 1.0 CD1 A:LEU24 4.1 7.7 1.0 CG B:LEU24 4.2 17.6 1.0 CG A:LEU24 4.2 12.8 1.0 CG2 B:VAL33 4.2 10.9 1.0 CD A:LYS36 4.3 12.9 1.0 CD B:LYS36 4.3 16.2 1.0 CG2 A:VAL33 4.3 10.3 1.0 CB A:VAL33 4.7 12.5 1.0 CB B:VAL33 4.7 15.6 1.0 CA A:LEU24 4.8 9.1 1.0 CA B:LEU24 4.9 13.5 1.0 O A:LEU24 5.0 15.8 1.0

M.J.Allert, S.Kumar, Y.Wang, L.S.Beese, H.W.Hellinga. Structure-Based Functional Analysis Reveals Multiple Roles and Widespread Use of Urea-Binding Proteins in Nitrogen Metabolism To Be Published.