Chlorine in PDB 8qls: Human MST3 (STK24) Kinase in Complex with Inhibitor MR26

All present enzymatic activity of Human MST3 (STK24) Kinase in Complex with Inhibitor MR26:
2.7.11.1;

The structure of Human MST3 (STK24) Kinase in Complex with Inhibitor MR26, PDB code: 8qls was solved by D.I.Balourdas, M.Rak, S.Knapp, A.C.Joerger, Structural Genomicsconsortium (Sgc), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	39.55 / 1.61
Space group	C 1 2 1
Cell size a, b, c (Å), α, β, γ (°)	99.109, 58.762, 61.495, 90, 93.06, 90
R / Rfree (%)	14.9 / 18.4

The binding sites of Chlorine atom in the Human MST3 (STK24) Kinase in Complex with Inhibitor MR26 (pdb code 8qls). 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 Human MST3 (STK24) Kinase in Complex with Inhibitor MR26, PDB code: 8qls:

Chlorine binding site 1 out of 1 in the Human MST3 (STK24) Kinase in Complex with Inhibitor MR26


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Human MST3 (STK24) Kinase in Complex with Inhibitor MR26 within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl401 b:30.0 occ:1.00 CL A:VYH401 0.0 30.0 1.0 C28 A:VYH401 1.7 27.3 1.0 C29 A:VYH401 2.7 27.7 1.0 C9 A:VYH401 2.7 25.5 1.0 C10 A:VYH401 3.1 22.6 1.0 CG A:MET111 3.2 25.6 0.3 C11 A:VYH401 3.3 21.3 1.0 O A:ALA63 3.5 25.2 1.0 CB A:MET111 3.7 26.4 0.7 CB A:ALA63 3.7 25.1 1.0 CB A:MET111 3.7 25.0 0.3 C A:ALA63 3.8 23.5 1.0 N A:LYS65 3.8 25.5 1.0 CG A:MET111 3.9 27.1 0.7 CG1 A:VAL50 4.0 27.5 1.0 C6 A:VYH401 4.0 26.0 1.0 C8 A:VYH401 4.0 26.5 1.0 CB A:LYS65 4.0 26.9 1.0 C27 A:VYH401 4.0 24.9 1.0 O A:ILE109 4.1 25.5 1.0 N A:ILE64 4.1 23.9 1.0 C A:ILE64 4.2 25.7 1.0 SD A:MET111 4.3 27.8 0.7 N A:MET111 4.3 24.4 0.3 N A:MET111 4.4 24.7 0.7 CA A:ALA63 4.4 21.7 1.0 CA A:ILE64 4.4 24.8 1.0 C12 A:VYH401 4.4 21.5 1.0 O1 A:VYH401 4.5 26.6 1.0 CA A:LYS65 4.5 25.1 1.0 C7 A:VYH401 4.5 28.4 1.0 CA A:MET111 4.6 24.4 0.7 CA A:MET111 4.6 24.1 0.3 CG2 A:VAL50 4.8 26.9 1.0 SD A:MET111 4.9 25.2 0.3 N4 A:VYH401 4.9 24.4 1.0 O A:ILE64 5.0 27.1 1.0 C A:ILE109 5.0 24.4 1.0

D.I.Balourdas, M.Rak, S.Knapp, A.C.Joerger. Human MST3 (STK24) Kinase in Complex with Inhibitor MR26 To Be Published.