Chlorine in PDB 6rxb: Crystal Structure of Tetr-Q116A From Acinetobacter Baumannii Aye in Complex with Minocycline

The structure of Crystal Structure of Tetr-Q116A From Acinetobacter Baumannii Aye in Complex with Minocycline, PDB code: 6rxb was solved by H.K.Tam, S.Himpich, K.M.Pos, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	48.41 / 2.25
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	62.543, 64.227, 220.954, 90.00, 90.00, 90.00
R / Rfree (%)	24 / 27.6

The structure of Crystal Structure of Tetr-Q116A From Acinetobacter Baumannii Aye in Complex with Minocycline also contains other interesting chemical elements:

Magnesium

(Mg)

4 atoms

The binding sites of Chlorine atom in the Crystal Structure of Tetr-Q116A From Acinetobacter Baumannii Aye in Complex with Minocycline (pdb code 6rxb). 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 Tetr-Q116A From Acinetobacter Baumannii Aye in Complex with Minocycline, PDB code: 6rxb:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Crystal Structure of Tetr-Q116A From Acinetobacter Baumannii Aye in Complex with Minocycline


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 Tetr-Q116A From Acinetobacter Baumannii Aye in Complex with Minocycline within 5.0Å range: probe atom residue distance (Å) B Occ D:Cl303 b:49.1 occ:1.00 NE D:ARG129 3.1 53.5 1.0 NH2 D:ARG129 3.2 55.0 1.0 ND1 D:HIS210 3.2 59.9 1.0 N D:HIS209 3.2 56.3 1.0 CZ D:ARG129 3.6 54.4 1.0 CB D:HIS209 3.7 53.2 1.0 CA D:HIS209 3.8 54.6 1.0 C D:HIS209 3.8 54.3 1.0 CZ3 D:TRP132 3.8 53.6 1.0 N D:HIS210 3.9 56.3 1.0 CE1 D:HIS210 4.1 62.4 1.0 CG D:HIS210 4.2 59.3 1.0 O D:THR207 4.2 58.0 1.0 CD D:ARG129 4.2 53.2 1.0 CG D:ARG129 4.3 52.7 1.0 C D:ASP208 4.3 57.8 1.0 CD1 C:PHE190 4.3 46.5 1.0 CB D:HIS210 4.3 57.0 1.0 O D:HIS209 4.4 52.6 1.0 CA D:ASP208 4.5 59.8 1.0 OD1 D:ASP208 4.5 60.2 1.0 CE3 D:TRP132 4.6 51.8 1.0 CE1 C:PHE190 4.6 46.9 1.0 CG D:HIS209 4.6 53.7 1.0 CH2 D:TRP132 4.7 55.5 1.0 CA D:HIS210 4.8 56.6 1.0 CD2 D:HIS209 4.8 54.6 1.0 NH1 D:ARG129 4.9 54.9 1.0

Chlorine binding site 2 out of 2 in the Crystal Structure of Tetr-Q116A From Acinetobacter Baumannii Aye in Complex with Minocycline


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 Tetr-Q116A From Acinetobacter Baumannii Aye in Complex with Minocycline within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl304 b:86.0 occ:1.00 NE A:ARG129 3.4 48.1 1.0 SG A:CYS126 3.8 51.5 0.7 NH1 A:ARG129 4.2 49.3 1.0 CD A:ARG129 4.2 46.9 1.0 CZ A:ARG129 4.3 48.0 1.0 CG A:ARG129 4.3 46.0 1.0 CZ3 A:TRP132 4.5 45.6 1.0 CB A:LYS128 4.6 50.3 1.0 CD A:LYS128 4.6 54.0 1.0 CH2 A:TRP132 4.7 47.0 1.0 O A:HOH430 5.0 50.9 1.0

H.K.Tam, S.Himpich, K.M.Pos. Crystal Structure of Tetr-Q116A From Acinetobacter Baumannii Aye in Complex with Minocycline To Be Published.