Fluorine in PDB 2izs: Structure of Casein Kinase Gamma 3 in Complex with Inhibitor

All present enzymatic activity of Structure of Casein Kinase Gamma 3 in Complex with Inhibitor:
2.7.11.1;

The structure of Structure of Casein Kinase Gamma 3 in Complex with Inhibitor, PDB code: 2izs was solved by G.Bunkoczi, E.Salah, P.Rellos, S.Das, O.Fedorov, P.Savitsky, J.E.Debreczeni, O.Gileadi, M.Sundstrom, A.Edwards, C.Arrowsmith, J.Weigelt, F.Von Delft, S.Knapp, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	29.26 / 1.95
Space group	P 31 2 1
Cell size a, b, c (Å), α, β, γ (°)	56.029, 56.029, 220.089, 90.00, 90.00, 120.00
R / Rfree (%)	17.9 / 23.4

The structure of Structure of Casein Kinase Gamma 3 in Complex with Inhibitor also contains other interesting chemical elements:

Magnesium	(Mg)	2 atoms
Chlorine	(Cl)	3 atoms

The binding sites of Fluorine atom in the Structure of Casein Kinase Gamma 3 in Complex with Inhibitor (pdb code 2izs). This binding sites where shown within 5.0 Angstroms radius around Fluorine atom.
In total only one binding site of Fluorine was determined in the Structure of Casein Kinase Gamma 3 in Complex with Inhibitor, PDB code: 2izs:

Fluorine binding site 1 out of 1 in the Structure of Casein Kinase Gamma 3 in Complex with Inhibitor


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 1 of Structure of Casein Kinase Gamma 3 in Complex with Inhibitor within 5.0Å range: probe atom residue distance (Å) B Occ A:F1334 b:27.6 occ:1.00 F A:BRQ1334 0.0 27.6 1.0 CAQ A:BRQ1334 1.3 17.7 1.0 CAG A:BRQ1334 2.4 14.2 1.0 CAH A:BRQ1334 2.4 15.7 1.0 OD1 A:ASN53 2.6 73.2 1.0 O A:HOH2033 3.4 26.8 1.0 CAJ A:BRQ1334 3.6 8.8 1.0 CAK A:BRQ1334 3.6 9.2 1.0 CG A:ASN53 3.7 60.8 1.0 CAU A:BRQ1334 4.1 22.0 1.0 O A:HOH2113 4.3 21.0 1.0 O A:HOH2121 4.3 25.6 1.0 ND2 A:ASN53 4.4 34.5 1.0 CB A:ASN53 4.8 69.7 1.0 CD2 A:LEU57 4.8 16.6 1.0 CB A:LEU57 4.9 13.5 1.0 CA A:ASN53 5.0 70.0 1.0

G.Bunkoczi, E.Salah, P.Rellos, S.Das, O.Fedorov, P.Savitsky, J.E.Debreczeni, O.Gileadi, M.Sundstrom, A.Edwards, C.Arrowsmith, J.Weigelt, F.Von Delft, S.Knapp. Inhibitor Binding By Casein Kinases To Be Published.