Chlorine in PDB 5ezr: Crystal Structure of PVX_084705 Bound to Compound

The structure of Crystal Structure of PVX_084705 Bound to Compound, PDB code: 5ezr was solved by M.El Bakkouri, M.Amani, J.R.Walker, S.Osborne, J.M.Large, K.Birchall, N.Bouloc, E.Smiljanic-Hurley, M.Wheldon, D.J.Harding, A.T.Merritt, K.H.Ansell, P.J.Coombs, C.A.Kettleborough, B.L.Stewart, P.W.Bowyer, W.E.Gutteridge, C.H.Arrowsmith, A.M.Edwards, C.Bountra, D.A.Baker, R.Hui, P.Loppnau, Structural Genomics Consortium (Sgc), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	50.00 / 2.50
Space group	C 1 2 1
Cell size a, b, c (Å), α, β, γ (°)	191.103, 117.967, 68.162, 90.00, 95.17, 90.00
R / Rfree (%)	22.5 / 26.6

The structure of Crystal Structure of PVX_084705 Bound to Compound also contains other interesting chemical elements:

Fluorine

(F)

1 atom

The binding sites of Chlorine atom in the Crystal Structure of PVX_084705 Bound to Compound (pdb code 5ezr). 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 PVX_084705 Bound to Compound, PDB code: 5ezr:

Chlorine binding site 1 out of 1 in the Crystal Structure of PVX_084705 Bound to Compound


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 PVX_084705 Bound to Compound within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl902 b:72.3 occ:1.00 O A:HOH1014 2.9 52.9 1.0 NH2 A:ARG485 3.2 58.7 1.0 N A:SER446 3.3 55.4 1.0 N A:ARG447 3.6 57.6 1.0 CA A:GLY445 3.7 62.8 1.0 OH A:TYR449 3.7 61.7 1.0 CB A:ARG447 3.7 66.1 1.0 C A:GLY445 4.0 56.5 1.0 CG A:ARG447 4.2 71.6 1.0 CD A:ARG447 4.2 77.8 1.0 CZ A:ARG485 4.2 58.4 1.0 CA A:ARG447 4.3 60.5 1.0 CE1 A:TYR449 4.3 56.5 1.0 NE A:ARG485 4.3 57.0 1.0 CA A:SER446 4.4 57.0 1.0 OG A:SER446 4.4 58.3 1.0 C A:SER446 4.4 56.3 1.0 CZ A:TYR449 4.5 57.3 1.0 O A:ARG447 4.6 60.7 1.0 C A:ARG447 4.9 59.9 1.0 CG1 A:ILE439 5.0 65.1 1.0 CB A:SER446 5.0 57.4 1.0 OE2 A:GLU443 5.0 69.9 1.0 N A:GLY445 5.0 65.2 1.0

M.El Bakkouri, M.Amani, J.R.Walker, S.Osborne, J.M.Large, K.Birchall, N.Bouloc, E.Smiljanic-Hurley, M.Wheldon, D.J.Harding, A.T.Merritt, K.H.Ansell, P.J.Coombs, C.A.Kettleborough, B.L.Stewart, P.W.Bowyer, W.E.Gutteridge, C.H.Arrowsmith, A.M.Edwards, C.Bountra, D.A.Baker, R.Hui, P.Loppnau. Crystal Structure of PVX_084705 Bound to Compound To Be Published.