Chlorine in PDB 6wii: Crystal Structure of the K. Pneumoniae Lpxh/Jh-Lph-41 Complex

Enzymatic activity of Crystal Structure of the K. Pneumoniae Lpxh/Jh-Lph-41 Complex

All present enzymatic activity of Crystal Structure of the K. Pneumoniae Lpxh/Jh-Lph-41 Complex:
3.6.1.54;

Protein crystallography data

The structure of Crystal Structure of the K. Pneumoniae Lpxh/Jh-Lph-41 Complex, PDB code: 6wii was solved by C.S.Cochrane, J.Cho, B.A.Fenton, P.Zhou, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 45.77 / 1.85
Space group P 32 2 1
Cell size a, b, c (Å), α, β, γ (°) 105.710, 105.710, 53.650, 90.00, 90.00, 120.00
R / Rfree (%) 16 / 18.7

Other elements in 6wii:

The structure of Crystal Structure of the K. Pneumoniae Lpxh/Jh-Lph-41 Complex also contains other interesting chemical elements:

Fluorine (F) 3 atoms
Manganese (Mn) 2 atoms

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Crystal Structure of the K. Pneumoniae Lpxh/Jh-Lph-41 Complex (pdb code 6wii). 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 the K. Pneumoniae Lpxh/Jh-Lph-41 Complex, PDB code: 6wii:

Chlorine binding site 1 out of 1 in 6wii

Go back to Chlorine Binding Sites List in 6wii
Chlorine binding site 1 out of 1 in the Crystal Structure of the K. Pneumoniae Lpxh/Jh-Lph-41 Complex


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 the K. Pneumoniae Lpxh/Jh-Lph-41 Complex within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl301

b:38.2
occ:1.00
CL34 A:U2V301 0.0 38.2 1.0
C33 A:U2V301 1.8 32.7 1.0
C01 A:U2V301 2.7 25.4 1.0
C32 A:U2V301 2.8 27.4 1.0
CA A:GLN138 3.6 29.4 1.0
CG A:GLN138 3.8 33.9 1.0
O A:VAL132 3.8 34.2 1.0
N A:GLN138 3.9 29.9 1.0
CB A:PHE141 3.9 27.3 1.0
C02 A:U2V301 4.0 25.8 1.0
O A:ILE137 4.0 29.0 1.0
C31 A:U2V301 4.1 32.6 1.0
CG2 A:ILE137 4.1 40.4 1.0
CE2 A:PHE82 4.1 25.0 1.0
CB A:GLN138 4.1 27.0 1.0
C A:ILE137 4.2 34.5 1.0
CA A:VAL132 4.2 31.3 1.0
CB A:VAL132 4.2 31.1 1.0
CG A:PHE141 4.3 27.0 1.0
CG1 A:VAL132 4.4 35.2 1.0
CD2 A:LEU83 4.4 29.9 1.0
C A:VAL132 4.4 31.5 1.0
C30 A:U2V301 4.5 30.4 1.0
CD2 A:PHE141 4.6 28.2 1.0
CZ A:PHE82 4.7 23.4 1.0
C A:GLN138 4.7 32.9 1.0
CD1 A:LEU83 4.8 24.7 1.0
O A:GLN138 4.8 28.5 1.0
CD A:GLN138 5.0 41.2 1.0
CB A:ILE137 5.0 38.9 1.0

Reference:

S.H.Kwak, C.S.Cochrane, A.F.Ennis, W.Y.Lim, C.G.Webster, J.Cho, B.A.Fenton, P.Zhou, J.Hong. Synthesis and Evaluation of Sulfonyl Piperazine Lpxh Inhibitors. Bioorg.Chem. V. 102 04055 2020.
ISSN: ISSN 0045-2068
PubMed: 32663666
DOI: 10.1016/J.BIOORG.2020.104055
Page generated: Sat Dec 12 14:30:50 2020

Last articles

Zn in 8WB0
Zn in 8WAX
Zn in 8WAU
Zn in 8WAZ
Zn in 8WAY
Zn in 8WAV
Zn in 8WAW
Zn in 8WAT
Zn in 8W7M
Zn in 8WD3
© Copyright 2008-2020 by atomistry.com
Home   |    Site Map   |    Copyright   |    Contact us   |    Privacy