Chlorine in PDB 6fts: Tetr(D) N82A Mutant in Complex with PEG4

The structure of Tetr(D) N82A Mutant in Complex with PEG4, PDB code: 6fts was solved by W.Hinrichs, G.J.Palm, L.Berndt, B.Girbardt, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	34.39 / 2.00
Space group	I 41 2 2
Cell size a, b, c (Å), α, β, γ (°)	68.779, 68.779, 180.140, 90.00, 90.00, 90.00
R / Rfree (%)	22.2 / 27.2

The binding sites of Chlorine atom in the Tetr(D) N82A Mutant in Complex with PEG4 (pdb code 6fts). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Tetr(D) N82A Mutant in Complex with PEG4, PDB code: 6fts:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Tetr(D) N82A Mutant in Complex with PEG4


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Tetr(D) N82A Mutant in Complex with PEG4 within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl302 b:47.6 occ:1.00 N A:ARG3 3.5 57.8 1.0 CA A:SER2 3.6 61.2 1.0 C A:SER2 3.8 60.0 1.0 O A:HOH496 4.3 59.1 1.0 CB A:SER2 4.3 65.5 1.0 CA A:ARG3 4.5 56.1 1.0 CB A:ARG3 4.5 57.6 1.0 O A:SER2 4.6 55.7 1.0 N A:SER2 4.7 58.3 1.0

Chlorine binding site 2 out of 2 in the Tetr(D) N82A Mutant in Complex with PEG4


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Tetr(D) N82A Mutant in Complex with PEG4 within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl303 b:56.9 occ:1.00 N A:LEU4 2.9 46.5 1.0 NH2 A:ARG3 3.4 70.4 1.0 CG A:ARG3 3.6 59.8 1.0 CA A:LEU4 3.7 43.4 1.0 CB A:LEU4 3.7 43.8 1.0 CA A:ARG3 3.8 56.1 1.0 C A:ARG3 3.9 54.9 1.0 C A:LEU4 4.0 44.5 1.0 CG A:LEU4 4.3 42.6 1.0 O A:SER2 4.3 55.7 1.0 N A:ASN5 4.3 45.1 1.0 CB A:ARG3 4.4 57.6 1.0 O A:LEU4 4.5 50.8 1.0 CZ A:ARG3 4.7 70.9 1.0 CD A:ARG3 4.8 65.3 1.0 CD1 A:LEU4 5.0 41.2 1.0 N A:ARG3 5.0 57.8 1.0

S.Werten, J.Schneider, G.J.Palm, W.Hinrichs. Modular Organisation of Inducer Recognition and Allostery in the Tetracycline Repressor. Febs J. V. 283 2102 2016.
ISSN: ISSN 1742-4658
PubMed: 27028290
DOI: 10.1111/FEBS.13723