Chlorine in PDB 6gih: Crystal Structure of CK2ALPHA with CAM187 Bound

All present enzymatic activity of Crystal Structure of CK2ALPHA with CAM187 Bound:
2.7.11.1;

The structure of Crystal Structure of CK2ALPHA with CAM187 Bound, PDB code: 6gih was solved by P.Brear, J.Iegre, A.North, C.De Fusco, K.Georgiou, A.Lubin, L.Carro, H.Sore, M.Hyvonen, D.Spring, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	20.89 / 1.96
Space group	P 1 21 1
Cell size a, b, c (Å), α, β, γ (°)	59.488, 45.117, 62.889, 90.00, 111.23, 90.00
R / Rfree (%)	18 / 21.5

The binding sites of Chlorine atom in the Crystal Structure of CK2ALPHA with CAM187 Bound (pdb code 6gih). 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 CK2ALPHA with CAM187 Bound, PDB code: 6gih:

Chlorine binding site 1 out of 1 in the Crystal Structure of CK2ALPHA with CAM187 Bound


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 CK2ALPHA with CAM187 Bound within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl403 b:30.1 occ:1.00 CL A:EZN403 0.0 30.1 1.0 C3 A:EZN403 1.7 27.5 1.0 C4 A:EZN403 2.7 25.6 1.0 C2 A:EZN403 2.7 27.6 1.0 CB A:TYR39 3.5 20.9 1.0 CG2 A:VAL67 3.7 19.0 1.0 CD2 A:TYR39 3.9 20.9 1.0 CG A:TYR39 3.9 21.0 1.0 CG1 A:VAL67 3.9 19.2 1.0 C1 A:EZN403 4.0 28.0 1.0 C5 A:EZN403 4.0 24.0 1.0 CD2 A:LEU41 4.1 21.8 1.0 CG2 A:VAL101 4.1 23.3 1.0 CB A:VAL67 4.4 19.6 1.0 O A:GLN36 4.5 23.1 1.0 CG2 A:VAL112 4.5 14.7 1.0 C6 A:EZN403 4.5 25.2 1.0 CA A:TYR39 4.9 21.2 1.0 CE2 A:TYR39 4.9 20.5 1.0 CD1 A:TYR39 4.9 22.6 1.0 CG A:LEU41 5.0 22.8 1.0 O A:TYR39 5.0 23.0 1.0

P.Brear, A.North, J.Iegre, K.Hadje Georgiou, A.Lubin, L.Carro, W.Green, H.F.Sore, M.Hyvonen, D.R.Spring. Novel Non-Atp Competitive Small Molecules Targeting the CK2 Alpha / Beta Interface. Bioorg. Med. Chem. V. 26 3016 2018.
ISSN: ESSN 1464-3391
PubMed: 29759799
DOI: 10.1016/J.BMC.2018.05.011