Chlorine in PDB 3o61: Structure of the E100A E.Coli Gdp-Mannose Hydrolase (Yffh) in Complex with Gdp-Mannose and Mg++

The structure of Structure of the E100A E.Coli Gdp-Mannose Hydrolase (Yffh) in Complex with Gdp-Mannose and Mg++, PDB code: 3o61 was solved by L.M.Amzel, S.B.Gabelli, A.N.Boto, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	32.40 / 2.45
Space group	P 1 21 1
Cell size a, b, c (Å), α, β, γ (°)	54.276, 55.824, 158.121, 90.00, 91.71, 90.00
R / Rfree (%)	22.4 / 29

The structure of Structure of the E100A E.Coli Gdp-Mannose Hydrolase (Yffh) in Complex with Gdp-Mannose and Mg++ also contains other interesting chemical elements:

Magnesium	(Mg)	4 atoms
Sodium	(Na)	2 atoms

The binding sites of Chlorine atom in the Structure of the E100A E.Coli Gdp-Mannose Hydrolase (Yffh) in Complex with Gdp-Mannose and Mg++ (pdb code 3o61). 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 Structure of the E100A E.Coli Gdp-Mannose Hydrolase (Yffh) in Complex with Gdp-Mannose and Mg++, PDB code: 3o61:

Chlorine binding site 1 out of 1 in the Structure of the E100A E.Coli Gdp-Mannose Hydrolase (Yffh) in Complex with Gdp-Mannose and Mg++


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Structure of the E100A E.Coli Gdp-Mannose Hydrolase (Yffh) in Complex with Gdp-Mannose and Mg++ within 5.0Å range: probe atom residue distance (Å) B Occ C:Cl240 b:62.6 occ:1.00 CA C:GLY106 4.3 57.0 1.0 NH2 C:ARG141 4.7 82.9 1.0 O C:GLY106 4.8 61.1 1.0 O C:THR105 5.0 55.2 1.0

A.N.Boto, W.Xu, J.Jakoncic, A.Pannuri, T.Romeo, M.J.Bessman, S.B.Gabelli, L.M.Amzel. Structural Studies of the Nudix Gdp-Mannose Hydrolase From E. Coli Reveals A New Motif For Mannose Recognition. Proteins V. 79 2455 2011.
ISSN: ISSN 0887-3585
PubMed: 21638333
DOI: 10.1002/PROT.23069