Chlorine in PDB 7pwd: Structure of An Inhibited GRK2-G-Beta and G-Gamma Complex

All present enzymatic activity of Structure of An Inhibited GRK2-G-Beta and G-Gamma Complex:
2.7.11.15;

The structure of Structure of An Inhibited GRK2-G-Beta and G-Gamma Complex, PDB code: 7pwd was solved by N.Faucher, M.J.Tauchert, D.L.Konz Makino, L.M.Vuillard, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	111.56 / 2.60
Space group	C 1 2 1
Cell size a, b, c (Å), α, β, γ (°)	185.6, 74.549, 123.411, 90, 115.31, 90
R / Rfree (%)	19.2 / 23

The binding sites of Chlorine atom in the Structure of An Inhibited GRK2-G-Beta and G-Gamma Complex (pdb code 7pwd). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 4 binding sites of Chlorine where determined in the Structure of An Inhibited GRK2-G-Beta and G-Gamma Complex, PDB code: 7pwd:
Jump to Chlorine binding site number: 1; 2; 3; 4;

Chlorine binding site 1 out of 4 in the Structure of An Inhibited GRK2-G-Beta and G-Gamma Complex


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Structure of An Inhibited GRK2-G-Beta and G-Gamma Complex within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl701 b:93.3 occ:1.00 CL12 A:8DS701 0.0 93.3 1.0 C9 A:8DS701 1.7 75.1 1.0 C10 A:8DS701 2.7 63.0 1.0 C8 A:8DS701 2.7 65.9 1.0 N A:GLU204 3.3 78.0 1.0 O A:GLY203 3.4 87.1 1.0 C A:GLY203 3.4 82.4 1.0 CA A:GLU204 3.5 80.6 1.0 C A:GLU204 3.7 75.0 1.0 CD A:LYS220 3.7 73.6 1.0 CD2 A:LEU222 3.8 77.1 1.0 CG A:LYS220 3.9 75.8 1.0 N A:GLY200 4.0 87.9 1.0 C11 A:8DS701 4.0 65.8 1.0 O A:GLU204 4.0 73.7 1.0 C7 A:8DS701 4.0 70.4 1.0 CG2 A:VAL205 4.1 69.4 1.0 CA A:GLY200 4.1 86.0 1.0 N A:VAL205 4.2 70.7 1.0 CA A:GLY203 4.2 85.1 1.0 O A:CYS221 4.4 93.2 1.0 N A:GLY203 4.4 86.8 1.0 C6 A:8DS701 4.5 70.4 1.0 C A:ARG199 4.7 84.9 1.0 C A:GLY200 4.9 90.0 1.0

Chlorine binding site 2 out of 4 in the Structure of An Inhibited GRK2-G-Beta and G-Gamma Complex


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Structure of An Inhibited GRK2-G-Beta and G-Gamma Complex within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl701 b:69.3 occ:1.00 CL19 A:8DS701 0.0 69.3 1.0 C18 A:8DS701 1.7 64.2 1.0 C16 A:8DS701 2.7 68.1 1.0 C20 A:8DS701 2.7 68.5 1.0 O A:ILE197 3.1 74.4 1.0 C17 A:8DS701 3.1 75.5 1.0 C A:ILE197 3.8 79.3 1.0 N21 A:8DS701 3.9 60.9 1.0 C15 A:8DS701 4.0 62.4 1.0 CA A:GLY198 4.1 76.8 1.0 CG1 A:VAL205 4.1 68.4 1.0 CG1 A:ILE197 4.2 86.1 1.0 N A:GLY198 4.3 78.9 1.0 CB A:VAL205 4.4 69.0 1.0 CD1 A:ILE197 4.4 87.6 1.0 O A:MET274 4.4 64.8 1.0 C22 A:8DS701 4.5 65.3 1.0 C13 A:8DS701 4.5 72.1 1.0 CB A:ILE197 4.7 84.4 1.0 CG2 A:VAL205 4.8 69.4 1.0 CD2 A:LEU324 4.9 64.6 1.0 CA A:ILE197 4.9 82.2 1.0

Chlorine binding site 3 out of 4 in the Structure of An Inhibited GRK2-G-Beta and G-Gamma Complex


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of Structure of An Inhibited GRK2-G-Beta and G-Gamma Complex within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl702 b:93.9 occ:1.00 ND1 A:HIS328 3.6 70.6 1.0 OD2 A:ASP326 3.9 61.4 1.0 CD2 A:HIS330 3.9 49.7 1.0 OE1 A:GLN464 4.3 55.9 1.0 CE1 A:HIS328 4.4 72.2 1.0 CG A:HIS328 4.4 61.9 1.0 CB A:HIS328 4.5 59.3 1.0 NE2 A:HIS330 4.6 51.4 1.0 CD A:GLN464 4.6 55.1 1.0 CG A:HIS330 4.7 45.6 1.0 NE2 A:GLN464 4.8 47.5 1.0 CG A:ASP326 4.9 61.9 1.0 CB A:GLN464 5.0 52.9 1.0

Chlorine binding site 4 out of 4 in the Structure of An Inhibited GRK2-G-Beta and G-Gamma Complex


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 4 of Structure of An Inhibited GRK2-G-Beta and G-Gamma Complex within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl704 b:100.4 occ:1.00 SG A:CYS221 4.1 91.5 1.0 OH A:TYR206 4.1 82.4 1.0 CE1 A:TYR206 4.1 75.3 1.0 CZ A:TYR206 4.2 81.7 1.0 CE A:MET188 4.5 88.3 1.0 CE A:LYS266 4.8 91.2 1.0 CD1 A:TYR206 4.9 72.1 1.0 SD A:MET188 4.9 83.4 1.0 CB A:CYS221 5.0 81.1 1.0

N.Faucher, L.M.Vuillard. Structure of An Inhibited GRK2-G-Beta and G-Gamma Complex To Be Published.