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Chlorine in PDB 3kwk: Crystal Structure of Putative Nadh Dehydrogenase/Nad(P)H Nitroreductase (NP_809094.1) From Bacteroides Thetaiotaomicron Vpi- 5482 at 1.54 A Resolution

Protein crystallography data

The structure of Crystal Structure of Putative Nadh Dehydrogenase/Nad(P)H Nitroreductase (NP_809094.1) From Bacteroides Thetaiotaomicron Vpi- 5482 at 1.54 A Resolution, PDB code: 3kwk was solved by Joint Center For Structural Genomics (Jcsg), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 29.85 / 1.54
Space group P 43 21 2
Cell size a, b, c (Å), α, β, γ (°) 42.215, 42.215, 186.713, 90.00, 90.00, 90.00
R / Rfree (%) 14.6 / 17.6

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Crystal Structure of Putative Nadh Dehydrogenase/Nad(P)H Nitroreductase (NP_809094.1) From Bacteroides Thetaiotaomicron Vpi- 5482 at 1.54 A Resolution (pdb code 3kwk). 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 Crystal Structure of Putative Nadh Dehydrogenase/Nad(P)H Nitroreductase (NP_809094.1) From Bacteroides Thetaiotaomicron Vpi- 5482 at 1.54 A Resolution, PDB code: 3kwk:

Chlorine binding site 1 out of 1 in 3kwk

Go back to Chlorine Binding Sites List in 3kwk
Chlorine binding site 1 out of 1 in the Crystal Structure of Putative Nadh Dehydrogenase/Nad(P)H Nitroreductase (NP_809094.1) From Bacteroides Thetaiotaomicron Vpi- 5482 at 1.54 A Resolution


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Crystal Structure of Putative Nadh Dehydrogenase/Nad(P)H Nitroreductase (NP_809094.1) From Bacteroides Thetaiotaomicron Vpi- 5482 at 1.54 A Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl2

b:39.2
occ:1.00
O A:HOH257 2.8 18.9 0.5
N A:TYR189 3.0 8.0 1.0
N A:LYS188 3.2 8.5 1.0
CA A:GLN187 3.2 11.2 1.0
C A:GLN187 3.3 11.0 1.0
CB A:TYR189 3.3 13.4 1.0
CB A:GLN187 3.4 14.0 1.0
O A:HOH304 3.6 13.3 1.0
O A:HOH207 3.7 27.0 1.0
CA A:TYR189 3.8 10.4 1.0
O A:HOH256 3.8 39.5 1.0
O A:GLN187 4.0 11.9 1.0
C A:LYS188 4.1 10.3 1.0
CG A:GLN187 4.1 19.4 1.0
CA A:LYS188 4.2 9.7 1.0
O A:HOH257 4.2 23.7 0.5
O A:HOH202 4.3 33.9 1.0
N A:GLN187 4.7 10.7 1.0
O A:HOH319 4.7 12.9 1.0
NE2 A:GLN187 4.7 38.4 1.0
CG A:TYR189 4.7 17.9 1.0
CD A:GLN187 4.9 35.2 1.0
C A:TYR189 4.9 8.5 1.0
O A:TYR189 5.0 10.2 1.0
O A:LYS186 5.0 9.7 1.0

Reference:

Joint Center For Structural Genomics (Jcsg), Joint Center For Structural Genomics (Jcsg). N/A N/A.
Page generated: Fri Jul 11 07:07:27 2025

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