Chlorine in PDB 4fk7: Crystal Structure of Certhrax Catalytic Domain

The structure of Crystal Structure of Certhrax Catalytic Domain, PDB code: 4fk7 was solved by B.S.Hong, S.Dimov, W.Tempel, C.Bountra, C.H.Arrowsmith, A.M.Edwards, H.Park, Structural Genomics Consortium (Sgc), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	30.00 / 1.78
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	31.986, 71.832, 98.628, 90.00, 90.00, 90.00
R / Rfree (%)	17.1 / 20.3

The binding sites of Chlorine atom in the Crystal Structure of Certhrax Catalytic Domain (pdb code 4fk7). 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 Certhrax Catalytic Domain, PDB code: 4fk7:

Chlorine binding site 1 out of 1 in the Crystal Structure of Certhrax Catalytic Domain


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 Certhrax Catalytic Domain within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl1002 b:25.7 occ:1.00 N A:GLY361 3.3 21.1 1.0 NZ A:LYS458 3.4 17.1 1.0 NE A:ARG358 3.4 12.0 1.0 CG A:ARG358 3.8 12.7 1.0 N A:ASN360 3.8 23.5 1.0 CA A:GLY361 3.9 18.2 1.0 CE A:LYS458 3.9 16.6 1.0 CD A:ARG358 4.0 12.1 1.0 CD A:LYS458 4.0 16.2 1.0 O A:ARG358 4.1 15.3 1.0 CB A:ARG358 4.2 13.0 1.0 CZ A:ARG358 4.3 12.1 1.0 C A:ASN360 4.3 22.1 1.0 C A:ARG358 4.3 14.9 1.0 CA A:ASN360 4.3 25.4 1.0 C A:GLN359 4.4 20.1 1.0 O A:HOH1247 4.4 28.4 1.0 NH2 A:ARG358 4.4 13.0 1.0 CA A:GLN359 4.6 20.5 1.0 N A:GLN359 4.6 16.9 1.0 C A:GLY361 4.9 16.8 1.0 CA A:ARG358 4.9 13.3 1.0

D.Visschedyk, A.Rochon, W.Tempel, S.Dimov, H.W.Park, A.R.Merrill. Certhrax Toxin, An Anthrax-Related Adp-Ribosyltransferase From Bacillus Cereus. J.Biol.Chem. V. 287 41089 2012.
ISSN: ISSN 0021-9258
PubMed: 22992735
DOI: 10.1074/JBC.M112.412809