Chlorine in PDB 8s3l: X-Ray Crystal Structure of LSAA9A

All present enzymatic activity of X-Ray Crystal Structure of LSAA9A:
3.2.1.4;

The structure of X-Ray Crystal Structure of LSAA9A, PDB code: 8s3l was solved by K.E.H.Frandsen, V.Di Domenico, L.Lo Leggio, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	73.20 / 2.60
Space group	P 41 3 2
Cell size a, b, c (Å), α, β, γ (°)	126.72, 126.72, 126.72, 90, 90, 90
R / Rfree (%)	19.5 / 26.2

The structure of X-Ray Crystal Structure of LSAA9A also contains other interesting chemical elements:

Copper

(Cu)

1 atom

The binding sites of Chlorine atom in the X-Ray Crystal Structure of LSAA9A (pdb code 8s3l). 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 LSAA9A, PDB code: 8s3l:

Chlorine binding site 1 out of 1 in the X-Ray Crystal Structure of LSAA9A


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 LSAA9A within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl301 b:40.1 occ:1.00 CU A:CU302 2.4 37.2 1.0 CE1 A:HIC1 2.8 39.3 1.0 NE2 A:HIS78 3.0 36.1 1.0 ND1 A:HIC1 3.1 35.4 1.0 O A:HOH435 3.3 36.8 1.0 CE1 A:HIS78 3.3 39.2 1.0 NE2 A:HIS147 3.4 42.9 1.0 OE1 A:GLN162 3.5 45.2 1.0 OH A:TYR164 3.7 33.6 1.0 NE2 A:GLN162 3.7 39.7 1.0 C4 B:BGC2 3.8 42.6 1.0 C1 B:BGC3 3.9 39.5 1.0 CE1 A:HIS147 4.0 42.9 1.0 CD A:GLN162 4.0 40.8 1.0 CD2 A:HIS78 4.1 35.2 1.0 NE2 A:HIC1 4.1 40.6 1.0 O4 B:BGC2 4.3 37.9 1.0 C6 B:BGC2 4.4 44.1 1.0 CG A:HIC1 4.4 39.1 1.0 ND1 A:HIS78 4.5 41.0 1.0 N A:HIC1 4.5 40.5 1.0 CD2 A:HIS147 4.6 41.9 1.0 C5 B:BGC2 4.6 45.6 1.0 O5 B:BGC3 4.6 40.1 1.0 O3 B:BGC2 4.7 40.6 1.0 C3 B:BGC2 4.7 43.2 1.0 C5 B:BGC3 4.8 44.7 1.0 O5 B:BGC2 4.9 46.1 1.0 CZ A:HIC1 4.9 41.9 1.0 CG A:HIS78 4.9 37.6 1.0 C2 B:BGC3 4.9 41.1 1.0 CD2 A:HIC1 5.0 42.0 1.0 CZ A:TYR164 5.0 31.2 1.0

K.E.H.Frandsen, V.Di Domenico, L.Lo Leggio. X-Ray Crystal Structure of LSAA9A To Be Published.