Chlorine in PDB 4yjo: The Kinase Domain of Human Spleen Tyrosine (Syk) in Complex with GTC000222

All present enzymatic activity of The Kinase Domain of Human Spleen Tyrosine (Syk) in Complex with GTC000222:
2.7.10.2;

The structure of The Kinase Domain of Human Spleen Tyrosine (Syk) in Complex with GTC000222, PDB code: 4yjo was solved by D.O.Somers, M.Neu, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	20.00 / 1.60
Space group	P 1 21 1
Cell size a, b, c (Å), α, β, γ (°)	39.936, 84.821, 40.412, 90.00, 99.24, 90.00
R / Rfree (%)	18.4 / 23

The binding sites of Chlorine atom in the The Kinase Domain of Human Spleen Tyrosine (Syk) in Complex with GTC000222 (pdb code 4yjo). 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 The Kinase Domain of Human Spleen Tyrosine (Syk) in Complex with GTC000222, PDB code: 4yjo:

Chlorine binding site 1 out of 1 in the The Kinase Domain of Human Spleen Tyrosine (Syk) in Complex with GTC000222


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of The Kinase Domain of Human Spleen Tyrosine (Syk) in Complex with GTC000222 within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl701 b:29.4 occ:1.00 CL A:4DF701 0.0 29.4 1.0 C48 A:4DF701 1.7 27.1 1.0 C46 A:4DF701 2.7 26.6 1.0 C23 A:4DF701 2.7 28.0 1.0 C09 A:4DF701 2.9 28.2 1.0 N08 A:4DF701 3.1 27.4 1.0 C10 A:4DF701 3.2 30.7 1.0 C22 A:4DF701 3.4 26.9 1.0 CG1 A:VAL433 3.4 33.8 1.0 O A:HOH944 3.4 27.5 1.0 CB A:MET448 3.6 26.3 1.0 CG A:MET448 3.7 31.2 1.0 CD1 A:LEU501 3.8 27.7 1.0 C12 A:4DF701 3.9 30.2 1.0 N45 A:4DF701 3.9 25.4 1.0 N24 A:4DF701 4.0 26.6 1.0 C16 A:4DF701 4.0 30.1 1.0 C20 A:4DF701 4.1 26.9 1.0 CB A:VAL433 4.1 26.6 1.0 CG2 A:VAL433 4.2 25.3 1.0 C14 A:4DF701 4.2 32.0 1.0 O A:GLU449 4.4 28.7 1.0 C25 A:4DF701 4.4 28.1 1.0 CB A:SER511 4.5 26.7 1.0 CE A:MET448 4.5 30.6 1.0 C05 A:4DF701 4.6 28.9 1.0 CB A:ALA400 4.8 30.1 1.0 N17 A:4DF701 4.9 30.0 1.0 N19 A:4DF701 5.0 25.2 1.0 SD A:MET448 5.0 29.4 1.0

J.Liddle, F.L.Atkinson, M.D.Barker, P.S.Carter, N.R.Curtis, R.P.Davis, C.Douault, M.C.Dickson, D.Elwes, N.S.Garton, M.Gray, T.G.Hayhow, C.I.Hobbs, E.Jones, S.Leach, K.Leavens, H.D.Lewis, S.Mccleary, M.Neu, V.K.Patel, A.G.Preston, C.Ramirez-Molina, T.J.Shipley, P.A.Skone, N.Smithers, D.O.Somers, A.L.Walker, R.J.Watson, G.G.Weingarten. Discovery of GSK143, A Highly Potent, Selective and Orally Efficacious Spleen Tyrosine Kinase Inhibitor. Bioorg. Med. Chem. Lett. V. 21 6188 2011.
ISSN: ESSN 1464-3405
PubMed: 21903390
DOI: 10.1016/J.BMCL.2011.07.082