Chlorine in PDB 3rj4: Crystal Structure of 7-Cyano-7-Deazaguanine Reductase, Quef From Vibrio Cholerae

The structure of Crystal Structure of 7-Cyano-7-Deazaguanine Reductase, Quef From Vibrio Cholerae, PDB code: 3rj4 was solved by Y.Kim, M.Zhou, M.Gu, W.F.Anderson, A.Joachimiak, Center For Structuralgenomics Of Infectious Diseases (Csgid), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	35.07 / 1.75
Space group	C 1 2 1
Cell size a, b, c (Å), α, β, γ (°)	123.405, 71.841, 81.935, 90.00, 131.74, 90.00
R / Rfree (%)	16.1 / 19.1

The binding sites of Chlorine atom in the Crystal Structure of 7-Cyano-7-Deazaguanine Reductase, Quef From Vibrio Cholerae (pdb code 3rj4). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Crystal Structure of 7-Cyano-7-Deazaguanine Reductase, Quef From Vibrio Cholerae, PDB code: 3rj4:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Crystal Structure of 7-Cyano-7-Deazaguanine Reductase, Quef From Vibrio Cholerae


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 7-Cyano-7-Deazaguanine Reductase, Quef From Vibrio Cholerae within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl292 b:57.0 occ:1.00 O A:HOH433 2.6 51.9 1.0 O A:HOH358 3.1 29.9 1.0 N A:TRP113 3.2 23.2 1.0 O A:HOH400 3.5 28.2 1.0 CD1 A:TRP113 3.7 22.7 1.0 CA A:SER112 3.7 22.0 1.0 CB A:SER112 3.8 26.9 1.0 C A:SER112 4.0 21.8 1.0 CB A:TRP113 4.0 20.1 1.0 CG A:TRP113 4.1 21.8 1.0 CA A:TRP113 4.2 21.2 1.0 NE1 A:TRP113 4.7 20.8 1.0 O A:HOH434 4.9 64.9 1.0 O A:ALA111 5.0 30.4 1.0 OG A:SER112 5.0 29.0 1.0

Chlorine binding site 2 out of 2 in the Crystal Structure of 7-Cyano-7-Deazaguanine Reductase, Quef From Vibrio Cholerae


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Crystal Structure of 7-Cyano-7-Deazaguanine Reductase, Quef From Vibrio Cholerae within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl291 b:44.5 occ:1.00 OG B:SER182 2.6 28.7 0.8 CG B:HIS210 3.3 20.1 1.0 CD2 B:HIS210 3.3 20.2 1.0 ND1 B:HIS210 3.4 21.9 1.0 O B:HOH412 3.5 33.9 1.0 NE2 B:HIS210 3.5 23.8 1.0 CE1 B:HIS210 3.6 27.7 1.0 CB B:SER182 3.9 24.8 0.8 CB B:HIS210 4.0 16.9 1.0 CB B:SER182 4.0 24.8 0.2 OG B:SER182 4.6 26.0 0.2 CA B:SER182 4.9 20.5 0.2 CA B:SER182 5.0 18.1 0.8 CA B:HIS210 5.0 19.8 1.0

Y.Kim, M.Zhou, M.Gu, W.F.Anderson, A.Joachimiak, Csgid. Crystal Structure of 7-Cyano-7-Deazaguanine Reductase, Quef From Vibrio Cholerae To Be Published.