Chlorine in PDB 9qcu: Crystal Structure of Rhizobium Etli L-Asparaginase Reav S48A Mutant

The structure of Crystal Structure of Rhizobium Etli L-Asparaginase Reav S48A Mutant, PDB code: 9qcu was solved by K.Pokrywka, M.Grzechowiak, J.I.Loch, M.Ruszkowski, M.Gilski, M.Jaskolski, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	51.76 / 1.40
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	78.041, 91.34, 105.871, 90, 90, 90
R / Rfree (%)	14.9 / 17.9

The structure of Crystal Structure of Rhizobium Etli L-Asparaginase Reav S48A Mutant also contains other interesting chemical elements:

Zinc

(Zn)

2 atoms

The binding sites of Chlorine atom in the Crystal Structure of Rhizobium Etli L-Asparaginase Reav S48A Mutant (pdb code 9qcu). 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 Rhizobium Etli L-Asparaginase Reav S48A Mutant, PDB code: 9qcu:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Crystal Structure of Rhizobium Etli L-Asparaginase Reav S48A Mutant


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 Rhizobium Etli L-Asparaginase Reav S48A Mutant within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl411 b:37.3 occ:1.00 O A:HOH714 2.8 32.1 1.0 NE2 A:HIS20 2.8 12.5 1.0 ND2 A:ASN18 3.0 15.0 1.0 O A:HOH554 3.1 43.7 1.0 CG2 A:THR10 3.4 20.9 1.0 OG1 A:THR10 3.5 18.4 1.0 CE1 A:HIS20 3.5 13.9 1.0 CB A:ASN18 3.6 13.7 1.0 CG A:ASN18 3.8 13.6 1.0 CD2 A:HIS20 3.9 12.9 1.0 CB A:THR10 4.1 16.8 1.0 SD A:MET302 4.2 17.6 1.0 CG A:MET302 4.2 15.1 1.0 CE A:MET302 4.3 18.8 1.0 NH2 A:ARG333 4.4 25.6 1.0 ND2 A:ASN299 4.5 19.2 1.0 O B:ASP297 4.6 14.5 1.0 ND1 A:HIS20 4.7 13.2 1.0 CA A:ASN18 4.9 12.4 1.0 CG A:HIS20 4.9 13.0 1.0 OD1 A:ASN18 5.0 14.0 1.0

Chlorine binding site 2 out of 2 in the Crystal Structure of Rhizobium Etli L-Asparaginase Reav S48A Mutant


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 Rhizobium Etli L-Asparaginase Reav S48A Mutant within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl410 b:44.6 occ:1.00 NE2 B:HIS20 2.8 13.3 1.0 O B:HOH591 2.9 34.0 1.0 ND2 B:ASN18 3.0 15.3 1.0 OG1 B:THR10 3.4 17.9 1.0 CG2 B:THR10 3.5 20.9 1.0 CE1 B:HIS20 3.6 13.3 1.0 CB B:ASN18 3.6 13.7 1.0 CG B:ASN18 3.8 13.8 1.0 CD2 B:HIS20 3.9 11.6 1.0 CB B:THR10 4.0 17.6 1.0 SD B:MET302 4.1 16.6 1.0 CG B:MET302 4.3 14.1 1.0 CE B:MET302 4.3 17.4 1.0 NH2 B:ARG333 4.4 24.6 1.0 ND2 B:ASN299 4.6 18.3 1.0 O A:ASP297 4.6 15.0 1.0 ND1 B:HIS20 4.8 12.6 1.0 CA B:ASN18 4.9 12.3 1.0 CG B:HIS20 5.0 12.2 1.0

K.Pokrywka, M.Grzechowiak, J.I.Loch, M.Ruszkowski, M.Gilski, M.Jaskolski. Crystal Structure of Rhizobium Etli L-Asparaginase Reav S48A Mutant To Be Published.