Chlorine in PDB 6y85: Fragment KCL_1410 in Complex with Map Kinase P38-Alpha

All present enzymatic activity of Fragment KCL_1410 in Complex with Map Kinase P38-Alpha:
2.7.11.24;

The structure of Fragment KCL_1410 in Complex with Map Kinase P38-Alpha, PDB code: 6y85 was solved by G.F.De Nicola, C.E.Nichols, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	40.39 / 1.58
Space group	I 2 2 2
Cell size a, b, c (Å), α, β, γ (°)	80.786, 101.952, 103.960, 90.00, 90.00, 90.00
R / Rfree (%)	20.1 / 23.3

The structure of Fragment KCL_1410 in Complex with Map Kinase P38-Alpha also contains other interesting chemical elements:

Fluorine	(F)	1 atom
Calcium	(Ca)	4 atoms

The binding sites of Chlorine atom in the Fragment KCL_1410 in Complex with Map Kinase P38-Alpha (pdb code 6y85). 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 Fragment KCL_1410 in Complex with Map Kinase P38-Alpha, PDB code: 6y85:

Chlorine binding site 1 out of 1 in the Fragment KCL_1410 in Complex with Map Kinase P38-Alpha


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Fragment KCL_1410 in Complex with Map Kinase P38-Alpha within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl407 b:46.9 occ:1.00 N A:ASP324 3.7 23.6 1.0 ND1 A:HIS77 3.7 24.1 1.0 O A:PRO322 3.8 23.7 1.0 CE1 A:HIS77 3.8 24.8 1.0 CD1 A:TYR323 3.9 28.1 1.0 NH2 A:ARG73 4.0 30.6 1.0 CA A:TYR323 4.1 25.4 1.0 CB A:ASP324 4.3 28.6 1.0 CE1 A:TYR323 4.4 29.8 1.0 O A:HOH556 4.4 36.0 1.0 C A:TYR323 4.4 21.4 1.0 O A:HOH581 4.5 30.4 1.0 CA A:ASP324 4.6 26.3 1.0 C A:PRO322 4.7 21.9 1.0 CG A:HIS77 4.8 21.7 1.0 NE2 A:HIS77 4.8 24.7 1.0 CG A:TYR323 4.8 22.9 1.0 N A:TYR323 4.9 22.9 1.0 CB A:TYR323 5.0 22.2 1.0

G.F.De Nicola, C.E.Nichols. Fragment KCL_1410 in Complex with Map Kinase P38-Alpha To Be Published.