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Chlorine in PDB 4mpp: Crystal Structure of Benzoylformate Decarboxylase Mutant H281Y/T377P/F397T/A460I

Enzymatic activity of Crystal Structure of Benzoylformate Decarboxylase Mutant H281Y/T377P/F397T/A460I

All present enzymatic activity of Crystal Structure of Benzoylformate Decarboxylase Mutant H281Y/T377P/F397T/A460I:
4.1.1.7;

Protein crystallography data

The structure of Crystal Structure of Benzoylformate Decarboxylase Mutant H281Y/T377P/F397T/A460I, PDB code: 4mpp was solved by F.H.Andrews, M.J.Mcleish, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 22.45 / 1.50
Space group I 2 2 2
Cell size a, b, c (Å), α, β, γ (°) 81.356, 95.704, 137.163, 90.00, 90.00, 90.00
R / Rfree (%) 13.3 / 15.9

Other elements in 4mpp:

The structure of Crystal Structure of Benzoylformate Decarboxylase Mutant H281Y/T377P/F397T/A460I also contains other interesting chemical elements:

Calcium (Ca) 2 atoms
Sodium (Na) 2 atoms

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Crystal Structure of Benzoylformate Decarboxylase Mutant H281Y/T377P/F397T/A460I (pdb code 4mpp). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total only one binding site of Chlorine was determined in the Crystal Structure of Benzoylformate Decarboxylase Mutant H281Y/T377P/F397T/A460I, PDB code: 4mpp:

Chlorine binding site 1 out of 1 in 4mpp

Go back to Chlorine Binding Sites List in 4mpp
Chlorine binding site 1 out of 1 in the Crystal Structure of Benzoylformate Decarboxylase Mutant H281Y/T377P/F397T/A460I


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 Benzoylformate Decarboxylase Mutant H281Y/T377P/F397T/A460I within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl609

b:22.5
occ:1.00
 N A:ASP187 3.2 13.7 1.0
O A:HOH956 3.5 24.0 1.0
CG A:ASP187 3.6 23.2 1.0
CA A:ASN186 3.7 12.6 1.0
OD1 A:ASP187 3.8 23.1 1.0
CB A:ASP187 3.8 14.5 1.0
CB A:ASN186 3.9 13.3 1.0
OD2 A:ASP187 3.9 27.4 1.0
C A:ASN186 4.0 14.2 1.0
CA A:ASP187 4.1 12.9 1.0
O A:HOH1182 4.7 38.7 1.0
NH1 A:ARG184 4.9 16.9 1.0

Reference:

F.H.Andrews, M.G.Logsdon, H.R.Brodkin, A.M.Malik, J.D.Horton, D.Ringe, G.D.Petsko, M.J.Mcleish. A Pseudo Study of Thiamin Diphosphate-Dependent Decarboxylases To Be Published.
Page generated: Sun Jul 21 20:06:09 2024

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