Chlorine in PDB 4xa7: Soluble Part of Holo Nqrc From V. Harveyi

The structure of Soluble Part of Holo Nqrc From V. Harveyi, PDB code: 4xa7 was solved by V.Borshchevskiy, E.Round, Y.Bertsova, V.Polovinkin, I.Gushchin, A.Mishin, K.Kovalev, G.Kachalova, A.Popov, A.Bogachev, V.Gordeliy, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	46.53 / 1.56
Space group	P 1 21 1
Cell size a, b, c (Å), α, β, γ (°)	39.560, 55.410, 46.550, 90.00, 91.67, 90.00
R / Rfree (%)	19.9 / 22.2

The binding sites of Chlorine atom in the Soluble Part of Holo Nqrc From V. Harveyi (pdb code 4xa7). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total only one binding site of Chlorine was determined in the Soluble Part of Holo Nqrc From V. Harveyi, PDB code: 4xa7:

Chlorine binding site 1 out of 1 in the Soluble Part of Holo Nqrc From V. Harveyi


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Soluble Part of Holo Nqrc From V. Harveyi within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl302 b:30.0 occ:1.00 O A:HOH453 2.4 35.6 1.0 NE2 A:GLN97 3.4 30.6 1.0 N A:ALA123 3.4 23.4 1.0 CH2 A:TRP242 3.7 22.0 1.0 CE1 A:HIS145 3.8 28.9 1.0 O A:HOH465 3.9 34.1 1.0 CB A:ALA101 3.9 27.6 1.0 CZ2 A:TRP242 4.0 23.2 1.0 CB A:ALA123 4.0 22.9 1.0 CG A:GLN97 4.0 29.0 1.0 CA A:ARG122 4.0 24.1 1.0 CD A:GLN97 4.2 29.7 1.0 C A:ARG122 4.2 23.1 1.0 CG A:ARG122 4.3 25.0 1.0 CA A:ALA123 4.3 22.7 1.0 NE2 A:HIS145 4.5 29.6 1.0 O A:ARG121 4.6 24.6 1.0 O A:GLN97 4.6 29.4 1.0 CB A:ARG122 4.7 24.8 1.0 O A:ALA123 4.8 22.7 1.0 ND1 A:HIS145 4.8 28.6 1.0 O A:HOH484 4.9 28.5 1.0 CZ3 A:TRP242 4.9 23.6 1.0

V.Borshchevskiy, E.Round, Y.Bertsova, V.Polovinkin, I.Gushchin, A.Ishchenko, K.Kovalev, A.Mishin, G.Kachalova, A.Popov, A.Bogachev, V.Gordeliy. Structural and Functional Investigation of Flavin Binding Center of the Nqrc Subunit of Sodium-Translocating Nadh:Quinone Oxidoreductase From Vibrio Harveyi. Plos One V. 10 18548 2015.
ISSN: ESSN 1932-6203
PubMed: 25734798
DOI: 10.1371/JOURNAL.PONE.0118548