Chlorine in PDB 6jok: Crystal Structure of Pdgfra in Complex with Sunitinib By Soaking

All present enzymatic activity of Crystal Structure of Pdgfra in Complex with Sunitinib By Soaking:
2.7.10.1;

The structure of Crystal Structure of Pdgfra in Complex with Sunitinib By Soaking, PDB code: 6jok was solved by L.Liang, X.E.Yan, C.H.Yun, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	47.17 / 3.80
Space group	P 31 2 1
Cell size a, b, c (Å), α, β, γ (°)	102.611, 102.611, 111.301, 90.00, 90.00, 120.00
R / Rfree (%)	25.7 / 28.2

The structure of Crystal Structure of Pdgfra in Complex with Sunitinib By Soaking also contains other interesting chemical elements:

Fluorine

(F)

1 atom

The binding sites of Chlorine atom in the Crystal Structure of Pdgfra in Complex with Sunitinib By Soaking (pdb code 6jok). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Crystal Structure of Pdgfra in Complex with Sunitinib By Soaking, PDB code: 6jok:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Crystal Structure of Pdgfra in Complex with Sunitinib By Soaking


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Crystal Structure of Pdgfra in Complex with Sunitinib By Soaking within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl1002 b:44.9 occ:1.00 NE2 A:HIS654 3.6 67.5 1.0 CD2 A:HIS654 3.8 68.2 1.0 NH2 A:ARG804 3.8 71.8 1.0 CE1 A:HIS966 4.4 73.6 1.0 NE2 A:HIS966 4.7 73.2 1.0 OE2 A:GLU807 4.7 85.8 1.0 CE1 A:HIS654 4.8 66.8 1.0 CD2 A:PHE808 4.9 73.3 1.0

Chlorine binding site 2 out of 2 in the Crystal Structure of Pdgfra in Complex with Sunitinib By Soaking


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Crystal Structure of Pdgfra in Complex with Sunitinib By Soaking within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl1003 b:44.8 occ:1.00 ND1 A:HIS966 3.2 73.0 1.0 NZ A:LYS959 3.8 81.0 1.0 CE1 A:HIS966 3.9 73.6 1.0 CG A:GLU963 3.9 78.7 1.0 NH1 A:ARG804 4.0 69.8 1.0 CE1 A:TYR962 4.2 77.0 1.0 NH2 A:ARG804 4.2 71.8 1.0 CG A:HIS966 4.3 73.3 1.0 CD1 A:TYR962 4.4 77.7 1.0 CA A:GLU963 4.6 78.3 1.0 CZ A:ARG804 4.6 74.9 1.0 CB A:HIS966 4.6 71.0 1.0 CB A:GLU963 4.6 79.2 1.0 CE A:LYS959 4.8 79.9 1.0

L.Liang, X.E.Yan. Crystal Structure of Pdgfra in Complex with Sunitinib By Soaking To Be Published.