Chlorine in PDB 4f2e: Crystal Structure of the Streptococcus Pneumoniae D39 Copper Chaperone Cupa with Cu(I)

The structure of Crystal Structure of the Streptococcus Pneumoniae D39 Copper Chaperone Cupa with Cu(I), PDB code: 4f2e was solved by Y.Fu, C.E.Dann Iii, D.P.Giedroc, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	21.00 / 1.45
Space group	P 21 21 2
Cell size a, b, c (Å), α, β, γ (°)	47.208, 78.647, 23.455, 90.00, 90.00, 90.00
R / Rfree (%)	17.8 / 20

The structure of Crystal Structure of the Streptococcus Pneumoniae D39 Copper Chaperone Cupa with Cu(I) also contains other interesting chemical elements:

Copper

(Cu)

2 atoms

The binding sites of Chlorine atom in the Crystal Structure of the Streptococcus Pneumoniae D39 Copper Chaperone Cupa with Cu(I) (pdb code 4f2e). 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 the Streptococcus Pneumoniae D39 Copper Chaperone Cupa with Cu(I), PDB code: 4f2e:

Chlorine binding site 1 out of 1 in the Crystal Structure of the Streptococcus Pneumoniae D39 Copper Chaperone Cupa with Cu(I)


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 the Streptococcus Pneumoniae D39 Copper Chaperone Cupa with Cu(I) within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl203 b:10.5 occ:0.47 CU A:CU1202 2.3 13.4 1.0 SD A:MET113 3.4 11.8 1.0 CB A:CYS74 3.5 10.1 1.0 SD A:MET115 3.5 11.7 1.0 SG A:CYS74 3.5 10.9 1.0 O A:HOH365 3.5 21.8 1.0 CE A:MET115 3.7 12.3 1.0 CE A:MET113 3.8 13.5 1.0 CA A:CYS74 4.1 10.4 1.0 N A:CYS74 4.6 10.8 1.0

Y.Fu, H.C.Tsui, K.E.Bruce, L.T.Sham, K.A.Higgins, J.P.Lisher, K.M.Kazmierczak, M.J.Maroney, C.E.Dann, M.E.Winkler, D.P.Giedroc. A New Structural Paradigm in Copper Resistance in Streptococcus Pneumoniae. Nat.Chem.Biol. V. 9 177 2013.
ISSN: ISSN 1552-4450
PubMed: 23354287
DOI: 10.1038/NCHEMBIO.1168