Chlorine in PDB 1gw0: Crystal Structure of Laccase From Melanocarpus Albomyces in Four Copper Form

All present enzymatic activity of Crystal Structure of Laccase From Melanocarpus Albomyces in Four Copper Form:
1.10.3.2;

The structure of Crystal Structure of Laccase From Melanocarpus Albomyces in Four Copper Form, PDB code: 1gw0 was solved by N.Hakulinen, L.-L.Kiiskinen, K.Kruus, M.Saloheimo, A.Koivula, J.Rouvinen, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	100.00 / 2.40
Space group	P 1
Cell size a, b, c (Å), α, β, γ (°)	62.510, 72.300, 88.940, 110.40, 95.23, 109.74
R / Rfree (%)	18.9 / 24.8

The structure of Crystal Structure of Laccase From Melanocarpus Albomyces in Four Copper Form also contains other interesting chemical elements:

Copper

(Cu)

8 atoms

The binding sites of Chlorine atom in the Crystal Structure of Laccase From Melanocarpus Albomyces in Four Copper Form (pdb code 1gw0). 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 Laccase From Melanocarpus Albomyces in Four Copper Form, PDB code: 1gw0:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Crystal Structure of Laccase From Melanocarpus Albomyces in Four Copper Form


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 Laccase From Melanocarpus Albomyces in Four Copper Form within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl606 b:32.0 occ:1.00 CU A:CU605 2.5 26.8 1.0 NE2 A:HIS93 3.2 19.0 1.0 CE1 A:HIS93 3.2 16.4 1.0 O A:HOH805 3.2 27.1 1.0 N A:GLY96 3.2 15.3 1.0 O A:HOH744 3.3 8.9 1.0 NE2 A:HIS434 3.3 22.5 1.0 CE1 A:HIS434 3.3 20.1 1.0 CA A:HIS436 3.6 11.8 1.0 CA A:HIS95 3.8 18.5 1.0 O A:LEU435 3.9 15.0 1.0 C A:HIS95 4.0 17.5 1.0 O A:TRP94 4.0 19.7 1.0 CD2 A:HIS436 4.0 14.4 1.0 CG A:HIS436 4.1 13.0 1.0 CB A:HIS436 4.2 12.4 1.0 CA A:GLY96 4.2 14.9 1.0 N A:GLY437 4.3 14.2 1.0 N A:HIS436 4.4 12.6 1.0 C A:HIS436 4.5 13.4 1.0 ND1 A:HIS93 4.5 17.3 1.0 C A:LEU435 4.5 12.7 1.0 N A:ILE97 4.5 16.8 1.0 CD2 A:HIS93 4.5 14.0 1.0 O A:ILE97 4.6 18.4 1.0 ND1 A:HIS434 4.6 20.3 1.0 CD2 A:HIS434 4.6 18.0 1.0 C A:GLY96 4.6 17.3 1.0 N A:HIS95 4.6 19.5 1.0 C A:TRP94 4.7 18.7 1.0 CG A:HIS95 4.8 20.3 1.0 NE2 A:HIS436 4.8 16.8 1.0 CB A:HIS95 4.8 19.8 1.0 ND1 A:HIS436 4.9 13.1 1.0 OD1 A:ASP106 4.9 20.4 1.0

Chlorine binding site 2 out of 2 in the Crystal Structure of Laccase From Melanocarpus Albomyces in Four Copper Form


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 Laccase From Melanocarpus Albomyces in Four Copper Form within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl606 b:25.8 occ:1.00 CU B:CU605 2.4 27.3 1.0 NE2 B:HIS434 3.1 18.6 1.0 NE2 B:HIS93 3.1 21.4 1.0 CE1 B:HIS93 3.2 18.7 1.0 CE1 B:HIS434 3.3 12.5 1.0 N B:GLY96 3.3 14.8 1.0 O B:HOH740 3.5 9.0 1.0 CA B:HIS436 3.6 15.5 1.0 O B:LEU435 3.7 15.5 1.0 CA B:HIS95 3.9 16.1 1.0 CD2 B:HIS436 4.0 19.8 1.0 CG B:HIS436 4.1 18.7 1.0 C B:HIS95 4.1 16.1 1.0 O B:TRP94 4.2 18.1 1.0 CB B:HIS436 4.2 16.6 1.0 N B:GLY437 4.3 17.0 1.0 CA B:GLY96 4.3 19.0 1.0 CD2 B:HIS434 4.4 13.8 1.0 N B:HIS436 4.4 13.6 1.0 C B:LEU435 4.4 14.3 1.0 C B:HIS436 4.4 15.8 1.0 CD2 B:HIS93 4.4 19.5 1.0 ND1 B:HIS93 4.5 21.3 1.0 ND1 B:HIS434 4.6 15.2 1.0 N B:ILE97 4.7 22.9 1.0 N B:HIS95 4.7 16.4 1.0 CD2 B:HIS95 4.7 19.1 1.0 O B:ILE97 4.7 26.6 1.0 C B:GLY96 4.8 21.3 1.0 C B:TRP94 4.8 17.7 1.0 NE2 B:HIS436 4.8 22.3 1.0 ND1 B:HIS436 4.8 16.6 1.0 CG B:HIS95 4.8 17.1 1.0 O1 B:OXY601 4.9 19.3 1.0 CB B:HIS95 4.9 16.8 1.0 OD1 B:ASP106 4.9 16.1 1.0

N.Hakulinen, L.-L.Kiiskinen, K.Kruus, M.Saloheimo, A.Paananen, A.Koivula, J.Rouvinen. Crystal Structure of A Laccase From Melanocarpus Albomyces with An Intact Trinuclear Copper Site Nat.Struct.Biol. V. 9 601 2002.
ISSN: ISSN 1072-8368
PubMed: 12118243
DOI: 10.1038/NSB823