Chlorine in PDB 4dev: An Acetyl Xylan Esterase (EST2A) From the Rumen Bacterium Butyrivibrio Proteoclasticus.

The structure of An Acetyl Xylan Esterase (EST2A) From the Rumen Bacterium Butyrivibrio Proteoclasticus., PDB code: 4dev was solved by M.Till, V.L.Arcus, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	97.36 / 2.00
Space group	P 1
Cell size a, b, c (Å), α, β, γ (°)	90.112, 95.786, 98.787, 89.96, 99.74, 92.50
R / Rfree (%)	19 / 22.4

The binding sites of Chlorine atom in the An Acetyl Xylan Esterase (EST2A) From the Rumen Bacterium Butyrivibrio Proteoclasticus. (pdb code 4dev). 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 An Acetyl Xylan Esterase (EST2A) From the Rumen Bacterium Butyrivibrio Proteoclasticus., PDB code: 4dev:

Chlorine binding site 1 out of 1 in the An Acetyl Xylan Esterase (EST2A) From the Rumen Bacterium Butyrivibrio Proteoclasticus.


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of An Acetyl Xylan Esterase (EST2A) From the Rumen Bacterium Butyrivibrio Proteoclasticus. within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl404 b:33.0 occ:1.00 O A:GLY151 2.8 16.2 1.0 O4 A:PEG403 2.9 41.9 1.0 O A:GLY148 2.9 17.5 1.0 C A:TYR150 3.2 15.8 1.0 CA A:GLY347 3.3 21.3 1.0 N A:GLY151 3.4 15.7 1.0 C4 A:PEG403 3.4 41.4 1.0 O A:SER149 3.5 16.3 1.0 C A:SER149 3.5 16.6 1.0 O2 A:PEG403 3.5 42.2 1.0 CA A:TYR150 3.5 16.0 1.0 N A:TYR150 3.5 15.9 1.0 N A:SER348 3.6 19.8 1.0 O A:TYR150 3.6 15.9 1.0 C A:GLY347 3.8 21.3 1.0 C A:GLY151 3.8 16.4 1.0 C3 A:PEG403 3.9 42.4 1.0 C A:GLY148 3.9 17.9 1.0 CA A:GLY151 4.1 16.1 1.0 CD A:PRO354 4.1 17.4 1.0 O F:HOH510 4.2 12.5 1.0 CA A:SER149 4.3 16.7 1.0 N A:SER149 4.5 17.1 1.0 OG A:SER348 4.7 19.1 1.0 N A:GLY347 4.7 21.1 1.0 CA A:GLY353 4.7 16.6 1.0 C2 A:PEG403 4.7 40.9 1.0 CA A:SER348 4.7 19.8 1.0 O A:GLY347 4.8 22.2 1.0 CB A:SER348 4.8 19.6 1.0 CG A:PRO354 4.9 17.5 1.0 O A:HOH576 4.9 26.8 1.0 CB A:TYR150 5.0 15.5 1.0

M.Till, D.C.Goldstone, G.T.Attwood, C.D.Moon, W.J.Kelly, V.L.Arcus. Structure and Function of An Acetyl Xylan Esterase (EST2A) From the Rumen Bacterium Butyrivibrio Proteoclasticus. Proteins V. 81 911 2013.
ISSN: ISSN 0887-3585
PubMed: 23345031
DOI: 10.1002/PROT.24254