Chlorine in PDB 6nl2: Apo Nis Synthetase Desd Variant R306Q

The structure of Apo Nis Synthetase Desd Variant R306Q, PDB code: 6nl2 was solved by K.M.Hoffmann, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	58.27 / 1.92
Space group	P 2 21 21
Cell size a, b, c (Å), α, β, γ (°)	73.322, 95.696, 181.624, 90.00, 90.00, 90.00
R / Rfree (%)	16 / 18.6

The binding sites of Chlorine atom in the Apo Nis Synthetase Desd Variant R306Q (pdb code 6nl2). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 3 binding sites of Chlorine where determined in the Apo Nis Synthetase Desd Variant R306Q, PDB code: 6nl2:
Jump to Chlorine binding site number: 1; 2; 3;

Chlorine binding site 1 out of 3 in the Apo Nis Synthetase Desd Variant R306Q


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Apo Nis Synthetase Desd Variant R306Q within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl601 b:18.7 occ:1.00 O A:HOH728 3.0 24.6 1.0 OG A:SER278 3.0 15.1 1.0 O A:HOH1059 3.1 13.9 1.0 NZ A:LYS462 3.3 17.8 1.0 N A:SER278 3.3 11.9 1.0 CB A:SER278 3.5 13.9 1.0 CB A:GLN276 3.7 10.1 1.0 CE A:LYS462 3.7 19.0 1.0 N A:GLN277 3.9 10.2 1.0 CA A:SER278 4.0 12.9 1.0 O A:GLU445 4.0 11.8 1.0 OE2 A:GLU149 4.2 12.2 1.0 C A:GLN277 4.3 11.7 1.0 CB A:GLN277 4.4 11.9 1.0 CA A:GLN277 4.4 11.5 1.0 C A:GLN276 4.4 9.8 1.0 CB A:GLU445 4.5 14.8 1.0 CD A:LYS462 4.5 19.1 1.0 CD A:GLU445 4.5 19.1 1.0 CG A:GLU445 4.5 17.4 1.0 CB A:THR281 4.7 10.9 1.0 CA A:GLN276 4.7 9.8 1.0 CG A:GLN276 4.7 10.0 1.0 O A:HOH1040 4.8 9.7 1.0 OE1 A:GLU445 4.8 22.2 1.0 OE2 A:GLU445 4.9 21.4 1.0 CG2 A:THR281 4.9 11.4 1.0 C A:GLU445 4.9 11.3 1.0 OG1 A:THR281 5.0 11.2 1.0

Chlorine binding site 2 out of 3 in the Apo Nis Synthetase Desd Variant R306Q


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Apo Nis Synthetase Desd Variant R306Q within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl601 b:15.7 occ:1.00 O B:HOH840 3.0 20.5 1.0 O B:HOH1058 3.1 15.4 1.0 OG B:SER278 3.1 13.4 1.0 NZ B:LYS462 3.2 15.5 1.0 N B:SER278 3.4 11.3 1.0 CB B:SER278 3.5 12.5 1.0 CE B:LYS462 3.7 17.0 1.0 CB B:GLN276 3.7 10.0 1.0 N B:GLN277 4.0 10.6 1.0 O B:GLU445 4.0 11.6 1.0 CA B:SER278 4.1 11.8 1.0 C B:GLN277 4.3 11.1 1.0 OE2 B:GLU149 4.3 10.5 1.0 CB B:GLU445 4.4 13.2 1.0 CB B:GLN277 4.4 11.5 1.0 CA B:GLN277 4.4 11.3 1.0 CG B:GLU445 4.5 14.7 1.0 CD B:GLU445 4.5 16.1 1.0 C B:GLN276 4.5 9.9 1.0 CD B:LYS462 4.5 17.0 1.0 CB B:THR281 4.7 11.5 1.0 CA B:GLN276 4.7 9.9 1.0 OE1 B:GLU445 4.7 20.4 1.0 CG B:GLN276 4.7 10.1 1.0 CL B:CL602 4.8 28.3 1.0 CG2 B:THR281 4.9 12.5 1.0 OE2 B:GLU445 4.9 16.9 1.0 C B:GLU445 4.9 11.4 1.0 O B:HOH745 4.9 38.9 1.0 OG1 B:THR281 5.0 11.5 1.0

Chlorine binding site 3 out of 3 in the Apo Nis Synthetase Desd Variant R306Q


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of Apo Nis Synthetase Desd Variant R306Q within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl602 b:28.3 occ:1.00 NZ B:LYS462 3.2 15.5 1.0 NH2 B:ARG373 3.4 13.0 1.0 NH1 B:ARG373 3.5 13.8 1.0 NZ B:LYS294 3.5 19.4 1.0 OG1 B:THR281 3.6 11.5 1.0 CE B:LYS462 3.7 17.0 1.0 CG B:ASP463 3.8 19.1 1.0 CE B:LYS294 3.8 16.4 1.0 CZ B:ARG373 3.9 13.4 1.0 CB B:ASP463 3.9 16.6 1.0 O B:HOH725 4.0 28.6 1.0 OG B:SER278 4.0 13.4 1.0 O B:HOH745 4.0 38.9 1.0 OD1 B:ASP463 4.1 21.5 1.0 CD B:LYS294 4.2 14.8 1.0 OD2 B:ASP463 4.2 24.4 1.0 CB B:SER278 4.5 12.5 1.0 CA B:ASP463 4.5 15.5 1.0 CB B:THR281 4.6 11.5 1.0 OD1 B:ASN446 4.8 11.4 1.0 CG2 B:THR281 4.8 12.5 1.0 CG B:LYS294 4.8 13.3 1.0 CL B:CL601 4.8 15.7 1.0 N B:ASP463 5.0 14.8 1.0

K.M.Hoffmann, C.Amendola, E.Goncuian, K.Karimi, J.Kovak, Y.Mojab, G.Prussia. A C-Terminal Loop Mediates Cooperativity in the Nis Synthetase Desd To Be Published.