Chlorine in PDB 4i9o: Crystal Structure of Gackix L664C Tethered to 1-10

All present enzymatic activity of Crystal Structure of Gackix L664C Tethered to 1-10:
2.3.1.48;

The structure of Crystal Structure of Gackix L664C Tethered to 1-10, PDB code: 4i9o was solved by N.Wang, J.L.Meagher, J.A.Stuckey, A.K.Mapp, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	42.07 / 2.00
Space group	P 43 21 2
Cell size a, b, c (Å), α, β, γ (°)	48.330, 48.330, 85.464, 90.00, 90.00, 90.00
R / Rfree (%)	20.6 / 23.3

The structure of Crystal Structure of Gackix L664C Tethered to 1-10 also contains other interesting chemical elements:

Fluorine

(F)

3 atoms

The binding sites of Chlorine atom in the Crystal Structure of Gackix L664C Tethered to 1-10 (pdb code 4i9o). 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 Gackix L664C Tethered to 1-10, PDB code: 4i9o:

Chlorine binding site 1 out of 1 in the Crystal Structure of Gackix L664C Tethered to 1-10


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 Gackix L664C Tethered to 1-10 within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl701 b:56.1 occ:1.00 CL A:KI1701 0.0 56.1 1.0 C13 A:KI1701 1.7 49.3 1.0 C14 A:KI1701 2.7 49.0 1.0 C11 A:KI1701 2.7 46.6 1.0 F2 A:KI1701 3.0 49.0 1.0 C12 A:KI1701 3.1 48.4 1.0 F1 A:KI1701 3.1 49.2 1.0 O A:LEU628 3.2 23.8 1.0 CD1 A:ILE611 3.5 57.0 1.0 CB A:TYR631 3.6 23.2 1.0 CD2 A:TYR631 3.7 29.6 1.0 CA A:LEU628 3.9 24.5 1.0 C A:LEU628 3.9 25.9 1.0 CG A:TYR631 4.0 27.1 1.0 C15 A:KI1701 4.0 47.0 1.0 C10 A:KI1701 4.0 45.3 1.0 N A:ALA632 4.0 18.5 1.0 CD2 A:LEU628 4.1 33.2 1.0 CB A:LEU628 4.1 25.9 1.0 F3 A:KI1701 4.4 47.4 1.0 C A:TYR631 4.5 21.8 1.0 CG1 A:ILE611 4.5 42.6 1.0 C9 A:KI1701 4.5 45.8 1.0 CB A:ALA632 4.6 19.7 1.0 CA A:ALA632 4.6 19.4 1.0 CA A:TYR631 4.6 19.4 1.0 CE2 A:TYR631 4.7 31.3 1.0 CG A:LEU628 4.8 31.6 1.0

N.Wang, C.Y.Majmudar, W.C.Pomerantz, J.K.Gagnon, J.D.Sadowsky, J.L.Meagher, T.K.Johnson, J.A.Stuckey, C.L.Brooks, J.A.Wells, A.K.Mapp. Ordering A Dynamic Protein Via A Small-Molecule Stabilizer. J.Am.Chem.Soc. V. 135 3363 2013.
ISSN: ISSN 0002-7863
PubMed: 23384013
DOI: 10.1021/JA3122334