Chlorine in PDB 7k14: Ternary Soak Structure of Alkanesulfonate Monooxygenase Msud From Pseudomonas Fluorescens with Fmn and Methanesulfonate

All present enzymatic activity of Ternary Soak Structure of Alkanesulfonate Monooxygenase Msud From Pseudomonas Fluorescens with Fmn and Methanesulfonate:
1.14.14.5;

The structure of Ternary Soak Structure of Alkanesulfonate Monooxygenase Msud From Pseudomonas Fluorescens with Fmn and Methanesulfonate, PDB code: 7k14 was solved by J.J.M.Liew, D.P.Dowling, I.M.El Saudi, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	81.16 / 2.75
Space group	P 1 21 1
Cell size a, b, c (Å), α, β, γ (°)	94, 211.93, 94.35, 90, 119.05, 90
R / Rfree (%)	17.2 / 21.4

The binding sites of Chlorine atom in the Ternary Soak Structure of Alkanesulfonate Monooxygenase Msud From Pseudomonas Fluorescens with Fmn and Methanesulfonate (pdb code 7k14). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Ternary Soak Structure of Alkanesulfonate Monooxygenase Msud From Pseudomonas Fluorescens with Fmn and Methanesulfonate, PDB code: 7k14:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Ternary Soak Structure of Alkanesulfonate Monooxygenase Msud From Pseudomonas Fluorescens with Fmn and Methanesulfonate


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Ternary Soak Structure of Alkanesulfonate Monooxygenase Msud From Pseudomonas Fluorescens with Fmn and Methanesulfonate within 5.0Å range: probe atom residue distance (Å) B Occ G:Cl402 b:110.5 occ:1.00 NH2 G:ARG296 3.6 113.4 1.0 NE G:ARG225 3.6 95.6 1.0 NH1 G:ARG296 3.9 126.5 1.0 CE1 G:PHE6 4.0 88.0 1.0 NE1 G:TRP195 4.2 120.9 1.0 CB G:SER299 4.2 112.4 1.0 CZ G:ARG296 4.2 123.7 1.0 N G:SER299 4.3 123.0 1.0 CZ G:PHE6 4.3 90.6 1.0 CD G:ARG225 4.4 95.5 1.0 C6 G:FMN401 4.4 117.1 0.9 NH2 G:ARG225 4.4 99.1 1.0 CZ G:ARG225 4.5 96.2 1.0 CD2 G:LEU46 4.5 85.7 1.0 N5 G:FMN401 4.5 116.7 0.9 CG G:ARG225 4.6 101.4 1.0 C5A G:FMN401 4.6 118.4 0.9 CA G:SER299 4.9 117.5 1.0 CE2 G:TRP195 5.0 121.2 1.0

Chlorine binding site 2 out of 2 in the Ternary Soak Structure of Alkanesulfonate Monooxygenase Msud From Pseudomonas Fluorescens with Fmn and Methanesulfonate


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Ternary Soak Structure of Alkanesulfonate Monooxygenase Msud From Pseudomonas Fluorescens with Fmn and Methanesulfonate within 5.0Å range: probe atom residue distance (Å) B Occ H:Cl402 b:94.8 occ:1.00 NE H:ARG225 3.3 82.2 1.0 NH2 H:ARG296 3.7 123.8 1.0 CE1 H:PHE6 4.0 75.5 1.0 NH2 H:ARG225 4.1 85.4 1.0 CD H:ARG225 4.1 79.8 1.0 CZ H:ARG225 4.2 81.2 1.0 NH1 H:ARG296 4.2 129.4 1.0 NE1 H:TRP195 4.3 111.5 1.0 N H:SER299 4.3 136.6 1.0 CB H:SER299 4.3 113.7 1.0 CZ H:ARG296 4.5 126.0 1.0 CG H:ARG225 4.5 83.5 1.0 C6 H:FMN401 4.5 99.2 0.8 CZ H:PHE6 4.5 79.5 1.0 CD2 H:LEU46 4.5 71.0 1.0 N5 H:FMN401 4.6 99.5 0.8 C5A H:FMN401 4.7 100.8 0.8 CA H:SER299 4.9 124.2 1.0 CD1 H:PHE6 5.0 72.1 1.0

J.J.M.Liew, I.El Saudi, S.V.Nguyen, D.K.Wicht, D.P.Dowling. Structures of the Alkanesulfonate Monooxygenase Msud Provide Insight Into C-S Bond Cleavage, Substrate Scope, and An Unexpected Role For the Tetramer J.Biol.Chem. 2021.
ISSN: ESSN 1083-351X