Chlorine in PDB 4ea7: X-Ray Crystal Structure of Perb From Caulobacter Crescentus in Complex with Coa and Gdp-Perosamine at 1.0 Angstrom Resolution

The structure of X-Ray Crystal Structure of Perb From Caulobacter Crescentus in Complex with Coa and Gdp-Perosamine at 1.0 Angstrom Resolution, PDB code: 4ea7 was solved by J.B.Thoden, L.A.Reinhardt, P.D.Cook, P.Menden, W.W.Cleland, H.M.Holden, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	50.00 / 1.00
Space group	I 2 3
Cell size a, b, c (Å), α, β, γ (°)	114.858, 114.858, 114.858, 90.00, 90.00, 90.00
R / Rfree (%)	15.2 / 17.5

The binding sites of Chlorine atom in the X-Ray Crystal Structure of Perb From Caulobacter Crescentus in Complex with Coa and Gdp-Perosamine at 1.0 Angstrom Resolution (pdb code 4ea7). 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 X-Ray Crystal Structure of Perb From Caulobacter Crescentus in Complex with Coa and Gdp-Perosamine at 1.0 Angstrom Resolution, PDB code: 4ea7:

Chlorine binding site 1 out of 1 in the X-Ray Crystal Structure of Perb From Caulobacter Crescentus in Complex with Coa and Gdp-Perosamine at 1.0 Angstrom Resolution


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of X-Ray Crystal Structure of Perb From Caulobacter Crescentus in Complex with Coa and Gdp-Perosamine at 1.0 Angstrom Resolution within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl2003 b:22.5 occ:1.00 O A:HOH6257 2.8 31.3 1.0 NE A:ARG27 3.1 14.6 1.0 N A:VAL33 3.1 11.7 1.0 NH2 A:ARG27 3.7 15.8 1.0 O A:VAL33 3.8 13.4 1.0 CZ A:ARG27 3.9 14.3 1.0 CA A:THR32 3.9 14.0 1.0 O A:HOH6201 3.9 42.8 1.0 CB A:VAL33 3.9 12.1 1.0 CA A:VAL33 4.0 10.9 1.0 CG A:ARG27 4.0 13.5 1.0 C A:THR32 4.0 12.1 1.0 CD A:ARG27 4.1 16.4 1.0 CG2 A:THR32 4.2 25.7 1.0 CG2 A:VAL33 4.2 14.7 1.0 C A:VAL33 4.3 10.8 1.0 O A:HOH6194 4.4 27.3 1.0 O A:GLU31 4.5 15.6 1.0 O A:HOH6128 4.5 36.1 1.0 CB A:THR32 4.6 21.5 1.0

J.B.Thoden, L.A.Reinhardt, P.D.Cook, P.Menden, W.W.Cleland, H.M.Holden. Catalytic Mechanism of Perosamine N-Acetyltransferase Revealed By High-Resolution X-Ray Crystallographic Studies and Kinetic Analyses. Biochemistry V. 51 3433 2012.
ISSN: ISSN 0006-2960
PubMed: 22443398
DOI: 10.1021/BI300197H