Chlorine in PDB 4bn7: Nitroreductase Cind From Lactococcus Lactis in Complex with 2,6-Dichlorophenolindophenol

The structure of Nitroreductase Cind From Lactococcus Lactis in Complex with 2,6-Dichlorophenolindophenol, PDB code: 4bn7 was solved by S.Waltersperger, R.Baumgartner, A.E.Oberholzer, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	49.459 / 1.72
Space group	C 2 2 21
Cell size a, b, c (Å), α, β, γ (°)	54.109, 121.944, 68.888, 90.00, 90.00, 90.00
R / Rfree (%)	15.29 / 17.76

The binding sites of Chlorine atom in the Nitroreductase Cind From Lactococcus Lactis in Complex with 2,6-Dichlorophenolindophenol (pdb code 4bn7). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Nitroreductase Cind From Lactococcus Lactis in Complex with 2,6-Dichlorophenolindophenol, PDB code: 4bn7:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Nitroreductase Cind From Lactococcus Lactis in Complex with 2,6-Dichlorophenolindophenol


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Nitroreductase Cind From Lactococcus Lactis in Complex with 2,6-Dichlorophenolindophenol within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl1203 b:45.7 occ:1.00 CLC A:RLM1203 0.0 45.7 1.0 CAN A:RLM1203 1.7 42.5 1.0 CAP A:RLM1203 2.7 37.9 1.0 CAI A:RLM1203 2.7 51.3 1.0 HAI A:RLM1203 2.9 61.5 1.0 OAA A:RLM1203 2.9 30.6 1.0 O A:HOH2048 3.1 27.3 1.0 HAA A:RLM1203 3.2 36.7 1.0 O2' A:FMN504 3.6 16.8 1.0 N1 A:FMN504 3.7 15.4 1.0 OH A:TYR14 3.7 21.0 1.0 HH A:TYR14 3.8 25.2 1.0 C2 A:FMN504 3.9 23.9 1.0 HO2' A:FMN504 3.9 20.1 1.0 O2 A:FMN504 3.9 21.6 1.0 CAO A:RLM1203 4.0 43.3 1.0 CAQ A:RLM1203 4.0 64.5 1.0 C10 A:FMN504 4.3 20.3 1.0 H1'2 A:FMN504 4.3 14.1 1.0 O A:HOH2016 4.4 40.3 1.0 CAJ A:RLM1203 4.5 53.2 1.0 N3 A:FMN504 4.6 18.2 1.0 C2' A:FMN504 4.8 13.7 1.0 N10 A:FMN504 4.8 15.5 1.0 C1' A:FMN504 4.8 11.8 1.0 C4A A:FMN504 5.0 20.9 1.0

Chlorine binding site 2 out of 2 in the Nitroreductase Cind From Lactococcus Lactis in Complex with 2,6-Dichlorophenolindophenol


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Nitroreductase Cind From Lactococcus Lactis in Complex with 2,6-Dichlorophenolindophenol within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl1203 b:43.3 occ:1.00 CLD A:RLM1203 0.0 43.3 1.0 CAO A:RLM1203 1.7 43.3 1.0 CAP A:RLM1203 2.7 37.9 1.0 CAJ A:RLM1203 2.7 53.2 1.0 HAJ A:RLM1203 2.9 63.8 1.0 OAA A:RLM1203 2.9 30.6 1.0 N5 A:FMN504 2.9 18.6 1.0 HAA A:RLM1203 3.1 36.7 1.0 C4A A:FMN504 3.4 20.9 1.0 C5A A:FMN504 3.6 16.9 1.0 C4 A:FMN504 3.9 22.6 1.0 CAN A:RLM1203 4.0 42.5 1.0 CAQ A:RLM1203 4.0 64.5 1.0 O4 A:FMN504 4.0 21.6 1.0 H6 A:FMN504 4.1 21.3 1.0 C6 A:FMN504 4.2 17.8 1.0 C10 A:FMN504 4.2 20.3 1.0 C9A A:FMN504 4.3 12.4 1.0 N10 A:FMN504 4.5 15.5 1.0 CAI A:RLM1203 4.5 51.3 1.0 HD1 A:HIS152 4.8 22.3 1.0 HAH A:RLM1203 4.8 0.1 1.0 N3 A:FMN504 4.9 18.2 1.0

S.Waltersperger, R.Baumgartner, A.E.Oberholzer. Nitroreductase Cind From Lactococcus Lactis To Be Published.