Chlorine in PDB 2ih8: A Low-Dose Crystal Structure of A Recombinant Melanocarpus Albomyces Laccase

All present enzymatic activity of A Low-Dose Crystal Structure of A Recombinant Melanocarpus Albomyces Laccase:
1.10.3.2;

The structure of A Low-Dose Crystal Structure of A Recombinant Melanocarpus Albomyces Laccase, PDB code: 2ih8 was solved by N.Hakulinen, J.Rouvinen, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	25.00 / 2.00
Space group	C 1 2 1
Cell size a, b, c (Å), α, β, γ (°)	173.060, 61.810, 123.910, 90.00, 96.36, 90.00
R / Rfree (%)	18.3 / 21.3

The structure of A Low-Dose Crystal Structure of A Recombinant Melanocarpus Albomyces Laccase also contains other interesting chemical elements:

Copper

(Cu)

8 atoms

The binding sites of Chlorine atom in the A Low-Dose Crystal Structure of A Recombinant Melanocarpus Albomyces Laccase (pdb code 2ih8). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the A Low-Dose Crystal Structure of A Recombinant Melanocarpus Albomyces Laccase, PDB code: 2ih8:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the A Low-Dose Crystal Structure of A Recombinant Melanocarpus Albomyces Laccase


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of A Low-Dose Crystal Structure of A Recombinant Melanocarpus Albomyces Laccase within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl610 b:22.7 occ:1.00 CU A:CU604 2.5 15.6 1.0 NE2 A:HIS93 3.1 9.2 1.0 NE2 A:HIS434 3.1 11.8 1.0 N A:GLY96 3.1 11.4 1.0 O A:HOH856 3.1 18.4 1.0 O A:HOH819 3.2 8.5 1.0 CE1 A:HIS434 3.3 8.3 1.0 CE1 A:HIS93 3.3 8.4 1.0 CA A:HIS95 3.7 12.4 1.0 CA A:HIS436 3.7 10.6 1.0 O A:LEU435 3.9 8.6 1.0 C A:HIS95 3.9 12.2 1.0 O A:TRP94 3.9 11.2 1.0 CA A:GLY96 4.1 13.0 1.0 N A:GLY437 4.2 11.0 1.0 CG A:HIS436 4.3 11.7 1.0 CD2 A:HIS436 4.3 10.2 1.0 O A:ILE97 4.4 14.7 1.0 CB A:HIS436 4.4 10.7 1.0 CD2 A:HIS93 4.4 7.5 1.0 CD2 A:HIS434 4.4 8.0 1.0 N A:ILE97 4.5 12.9 1.0 C A:HIS436 4.5 10.6 1.0 N A:HIS436 4.5 9.0 1.0 C A:LEU435 4.5 7.4 1.0 N A:HIS95 4.5 12.1 1.0 C A:GLY96 4.5 12.8 1.0 CG A:HIS95 4.6 11.8 1.0 ND1 A:HIS434 4.6 8.4 1.0 ND1 A:HIS93 4.6 8.2 1.0 C A:TRP94 4.6 11.4 1.0 CB A:HIS95 4.6 11.1 1.0 CD2 A:HIS95 4.7 11.3 1.0 ND1 A:HIS436 4.9 12.6 1.0 OD1 A:ASP106 5.0 11.8 1.0 O A:HOH831 5.0 15.0 1.0 NE2 A:HIS436 5.0 12.6 1.0

Chlorine binding site 2 out of 2 in the A Low-Dose Crystal Structure of A Recombinant Melanocarpus Albomyces Laccase


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of A Low-Dose Crystal Structure of A Recombinant Melanocarpus Albomyces Laccase within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl610 b:27.0 occ:1.00 CU B:CU604 2.6 20.1 1.0 O B:HOH831 2.9 10.1 1.0 N B:GLY96 3.1 16.8 1.0 O B:HOH876 3.1 20.1 1.0 NE2 B:HIS434 3.2 13.9 1.0 NE2 B:HIS93 3.2 15.4 1.0 CE1 B:HIS434 3.3 12.8 1.0 CE1 B:HIS93 3.4 13.3 1.0 CA B:HIS95 3.7 15.4 1.0 CA B:HIS436 3.8 11.5 1.0 O B:LEU435 3.8 9.7 1.0 C B:HIS95 3.9 17.4 1.0 O B:TRP94 3.9 16.0 1.0 CA B:GLY96 4.0 18.0 1.0 N B:GLY437 4.2 12.0 1.0 O B:ILE97 4.2 17.5 1.0 N B:ILE97 4.4 17.6 1.0 CG B:HIS436 4.4 12.9 1.0 CD2 B:HIS436 4.4 10.9 1.0 C B:GLY96 4.4 18.5 1.0 CB B:HIS436 4.5 11.0 1.0 C B:LEU435 4.5 11.1 1.0 C B:HIS436 4.5 11.4 1.0 CD2 B:HIS434 4.5 12.0 1.0 CD2 B:HIS93 4.5 14.6 1.0 N B:HIS436 4.5 10.0 1.0 N B:HIS95 4.5 16.0 1.0 ND1 B:HIS434 4.6 14.6 1.0 CG B:HIS95 4.6 15.5 1.0 C B:TRP94 4.6 14.6 1.0 CB B:HIS95 4.6 14.8 1.0 CD2 B:HIS95 4.7 14.7 1.0 ND1 B:HIS93 4.7 14.0 1.0 C B:ILE97 4.9 18.0 1.0

N.Hakulinen, K.Kruus, A.Koivula, J.Rouvinen. A Crystallographic and Spectroscopic Study on the Effect of X-Ray Radiation on the Crystal Structure of Melanocarpus Albomyces Laccase. Biochem.Biophys.Res.Commun. V. 350 929 2006.
ISSN: ISSN 0006-291X
PubMed: 17045575
DOI: 10.1016/J.BBRC.2006.09.144