Chlorine in PDB 7luf: HSV1 Polymerase Ternary Complex with Dsdna and Pnu-183792

All present enzymatic activity of HSV1 Polymerase Ternary Complex with Dsdna and Pnu-183792:
2.7.7.7;

The structure of HSV1 Polymerase Ternary Complex with Dsdna and Pnu-183792, PDB code: 7luf was solved by R.P.Hayes, D.Klein, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	57.33 / 3.50
Space group	P 41
Cell size a, b, c (Å), α, β, γ (°)	181.3, 181.3, 233.685, 90, 90, 90
R / Rfree (%)	22.6 / 24.6

The binding sites of Chlorine atom in the HSV1 Polymerase Ternary Complex with Dsdna and Pnu-183792 (pdb code 7luf). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the HSV1 Polymerase Ternary Complex with Dsdna and Pnu-183792, PDB code: 7luf:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the HSV1 Polymerase Ternary Complex with Dsdna and Pnu-183792


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of HSV1 Polymerase Ternary Complex with Dsdna and Pnu-183792 within 5.0Å range: probe atom residue distance (Å) B Occ C:Cl1201 b:80.4 occ:1.00 CL11 C:YE41201 0.0 80.4 1.0 C10 C:YE41201 1.8 64.8 1.0 OG A:SER816 2.7 89.1 1.0 C12 C:YE41201 2.8 63.8 1.0 C09 C:YE41201 2.8 74.8 1.0 N A:GLN618 3.3 73.7 1.0 C A:GLN617 3.4 75.6 1.0 CA A:GLN618 3.4 64.2 1.0 O A:GLN617 3.4 73.6 1.0 CB A:GLN617 3.6 74.3 1.0 CB A:PHE820 3.6 61.6 1.0 O A:SER816 3.7 67.9 1.0 CA A:PHE820 3.9 67.5 1.0 N A:PHE820 4.0 68.2 1.0 CG A:GLN618 4.0 63.9 1.0 C13 C:YE41201 4.1 67.0 1.0 C08 C:YE41201 4.1 81.1 1.0 CB A:SER816 4.1 77.0 1.0 CA A:GLN617 4.2 74.1 1.0 CG2 A:VAL621 4.3 72.4 1.0 CD1 A:PHE820 4.3 64.6 1.0 CB A:GLN618 4.3 60.8 1.0 CG A:PHE820 4.5 61.7 1.0 C A:GLN618 4.5 65.6 1.0 C A:SER816 4.6 70.0 1.0 CB A:VAL621 4.6 55.7 1.0 C07 C:YE41201 4.6 70.1 1.0 CA A:SER816 4.7 75.1 1.0 O A:GLN618 4.9 61.3 1.0 CG A:GLN617 4.9 85.4 1.0 C A:GLY819 4.9 66.3 1.0 CD A:GLN617 5.0 86.2 1.0

Chlorine binding site 2 out of 2 in the HSV1 Polymerase Ternary Complex with Dsdna and Pnu-183792


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of HSV1 Polymerase Ternary Complex with Dsdna and Pnu-183792 within 5.0Å range: probe atom residue distance (Å) B Occ E:Cl1201 b:86.6 occ:1.00 CL11 E:YE41201 0.0 86.6 1.0 C10 E:YE41201 1.8 73.3 1.0 C12 E:YE41201 2.8 70.2 1.0 C09 E:YE41201 2.8 75.9 1.0 OG B:SER816 2.9 88.1 1.0 N B:GLN618 3.2 76.9 1.0 C B:GLN617 3.3 80.5 1.0 O B:GLN617 3.5 78.5 1.0 CA B:GLN618 3.5 71.7 1.0 CB B:GLN617 3.5 76.8 1.0 CB B:PHE820 3.6 69.4 1.0 O B:SER816 3.8 71.9 1.0 CA B:PHE820 3.8 72.2 1.0 N B:PHE820 4.0 76.5 1.0 CA B:GLN617 4.0 81.8 1.0 CG B:GLN618 4.0 69.6 1.0 C13 E:YE41201 4.1 75.4 1.0 C08 E:YE41201 4.1 72.3 1.0 CD1 B:PHE820 4.3 71.7 1.0 CB B:SER816 4.3 75.2 1.0 CG2 B:VAL621 4.3 72.3 1.0 CB B:GLN618 4.3 66.9 1.0 CG B:PHE820 4.4 66.8 1.0 C07 E:YE41201 4.6 75.3 1.0 C B:GLN618 4.6 72.3 1.0 C B:SER816 4.7 77.2 1.0 CB B:VAL621 4.7 58.2 1.0 CG B:GLN617 4.8 88.2 1.0 C B:GLY819 4.9 76.0 1.0 CA B:SER816 4.9 79.2 1.0 N B:GLN617 4.9 83.5 1.0

R.P.Hayes, M.Heo, M.Mason, J.Reid, C.Burlein, K.A.Armacost, D.M.Tellers, I.Raheem, A.W.Shaw, E.Murray, P.M.Mckenna, P.Abeywickrema, S.Sharma, S.M.Soisson, D.Klein. Structural Understanding of Non-Nucleoside Inhibition in An Elongating Herpesvirus Polymerase To Be Published.