Chlorine in PDB 3kng: Crystal Structure of Snoab, A Cofactor-Independent Oxygenase From Streptomyces Nogalater, Determined to 1.9 Resolution

The structure of Crystal Structure of Snoab, A Cofactor-Independent Oxygenase From Streptomyces Nogalater, Determined to 1.9 Resolution, PDB code: 3kng was solved by H.Koskiniemi, T.Grocholski, Y.Lindqvist, P.Mantsala, J.Niemi, G.Schneider, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	19.64 / 1.90
Space group	P 41 21 2
Cell size a, b, c (Å), α, β, γ (°)	82.681, 82.681, 83.417, 90.00, 90.00, 90.00
R / Rfree (%)	18.6 / 22.7

The binding sites of Chlorine atom in the Crystal Structure of Snoab, A Cofactor-Independent Oxygenase From Streptomyces Nogalater, Determined to 1.9 Resolution (pdb code 3kng). 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 Snoab, A Cofactor-Independent Oxygenase From Streptomyces Nogalater, Determined to 1.9 Resolution, PDB code: 3kng:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Crystal Structure of Snoab, A Cofactor-Independent Oxygenase From Streptomyces Nogalater, Determined to 1.9 Resolution


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 Snoab, A Cofactor-Independent Oxygenase From Streptomyces Nogalater, Determined to 1.9 Resolution within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl127 b:37.2 occ:1.00 O A:HOH137 3.0 56.0 1.0 O A:HOH164 3.1 37.4 1.0 N A:GLY81 3.4 26.0 1.0 CA A:GLY81 3.7 25.5 1.0 NE2 A:GLN79 3.8 32.8 1.0 CE2 A:PHE39 4.0 31.0 1.0 CB A:GLN79 4.1 27.6 1.0 CG A:PRO80 4.1 35.3 1.0 CD A:PRO80 4.2 32.8 1.0 N A:PRO80 4.4 29.6 1.0 CZ A:PHE39 4.4 24.6 1.0 C A:PRO80 4.6 26.6 1.0 CD A:GLN79 4.7 33.3 1.0 CG A:GLN79 4.7 27.0 1.0 C A:GLN79 4.7 27.7 1.0 CA A:GLN79 4.8 27.8 1.0 C A:GLY81 4.8 24.1 1.0 O A:HOH163 4.9 46.4 1.0 CA A:PRO80 4.9 29.0 1.0

Chlorine binding site 2 out of 2 in the Crystal Structure of Snoab, A Cofactor-Independent Oxygenase From Streptomyces Nogalater, Determined to 1.9 Resolution


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 Snoab, A Cofactor-Independent Oxygenase From Streptomyces Nogalater, Determined to 1.9 Resolution within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl127 b:73.6 occ:1.00 O B:HOH161 3.3 59.5 1.0

T.Grocholski, H.Koskiniemi, Y.Lindqvist, P.Mantsala, J.Niemi, G.Schneider. Crystal Structure of the Cofactor-Independent Monooxygenase Snoab From Streptomyces Nogalater: Implications For the Reaction Mechanism Biochemistry V. 49 934 2010.
ISSN: ISSN 0006-2960
PubMed: 20052967
DOI: 10.1021/BI901985B