Chlorine in PDB 7nry: Re-Refinement of Mapkap Kinase-2/Inhibitor Complex 3FYJ

All present enzymatic activity of Re-Refinement of Mapkap Kinase-2/Inhibitor Complex 3FYJ:
2.7.11.1;

The structure of Re-Refinement of Mapkap Kinase-2/Inhibitor Complex 3FYJ, PDB code: 7nry was solved by T.I.Croll, R.J.Read, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	29.51 / 3.80
Space group	F 41 3 2
Cell size a, b, c (Å), α, β, γ (°)	255.551, 255.551, 255.551, 90, 90, 90
R / Rfree (%)	23.4 / 27.5

The binding sites of Chlorine atom in the Re-Refinement of Mapkap Kinase-2/Inhibitor Complex 3FYJ (pdb code 7nry). 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 Re-Refinement of Mapkap Kinase-2/Inhibitor Complex 3FYJ, PDB code: 7nry:

Chlorine binding site 1 out of 1 in the Re-Refinement of Mapkap Kinase-2/Inhibitor Complex 3FYJ


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Re-Refinement of Mapkap Kinase-2/Inhibitor Complex 3FYJ within 5.0Å range: probe atom residue distance (Å) B Occ X:Cl402 b:110.9 occ:1.00 NZ X:LYS93 3.4 165.5 1.0 N X:PHE208 3.9 91.8 1.0 ND1 X:HIS108 4.0 63.0 1.0 CD X:LYS93 4.1 124.0 1.0 CE X:LYS93 4.1 176.9 1.0 N X:GLY209 4.2 86.5 1.0 CD1 X:ILE136 4.3 174.4 1.0 CB X:PHE208 4.3 78.8 1.0 C X:PHE208 4.3 100.4 1.0 CA X:PHE208 4.3 93.6 1.0 CD1 X:LEU95 4.6 152.6 1.0 CE1 X:HIS108 4.7 111.6 1.0 C X:ASP207 4.7 84.1 1.0 CA X:ASP207 4.7 93.6 1.0 CA X:GLY209 4.8 163.5 1.0 OD1 X:ASP207 4.9 106.1 1.0 O X:PHE208 4.9 130.9 1.0 O26 X:B97401 5.0 153.7 1.0

T.I.Croll, R.J.Read. Adaptive Cartesian and Torsional Restraints For Interactive Model Rebuilding. Acta Crystallogr D Struct V. 77 438 2021BIOL.
ISSN: ISSN 2059-7983
PubMed: 33825704
DOI: 10.1107/S2059798321001145