Chlorine in PDB 6psl: Structure of A N-Me-D-GLN4,D-Aza-THR8,ARG10-Teixobactin Analogue

The structure of Structure of A N-Me-D-GLN4,D-Aza-THR8,ARG10-Teixobactin Analogue, PDB code: 6psl was solved by J.S.Nowick, H.Yang, A.Pishenko, X.Li, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	15.28 / 2.10
Space group	P 32 2 1
Cell size a, b, c (Å), α, β, γ (°)	20.024, 20.024, 32.328, 90.00, 90.00, 120.00
R / Rfree (%)	9.2 / 11.7

The binding sites of Chlorine atom in the Structure of A N-Me-D-GLN4,D-Aza-THR8,ARG10-Teixobactin Analogue (pdb code 6psl). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total only one binding site of Chlorine was determined in the Structure of A N-Me-D-GLN4,D-Aza-THR8,ARG10-Teixobactin Analogue, PDB code: 6psl:

Chlorine binding site 1 out of 1 in the Structure of A N-Me-D-GLN4,D-Aza-THR8,ARG10-Teixobactin Analogue


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Structure of A N-Me-D-GLN4,D-Aza-THR8,ARG10-Teixobactin Analogue within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl101 b:5.6 occ:1.00 H2 A:Q3S8 2.5 5.7 1.0 H A:ARG10 2.5 3.1 1.0 H A:Q3S8 2.5 2.7 1.0 H A:ILE11 2.6 2.8 1.0 HB2 A:ARG10 3.1 5.3 1.0 HG23 A:ILE6 3.1 15.1 1.0 N A:ILE11 3.2 2.3 1.0 N2 A:Q3S8 3.2 4.7 1.0 HB A:ILE11 3.3 9.3 1.0 N A:ARG10 3.3 2.6 1.0 N A:Q3S8 3.3 2.3 1.0 H A:ALA9 3.4 3.9 1.0 H A:SER7 3.4 6.1 1.0 HG22 A:ILE6 3.4 15.1 1.0 OG A:SER7 3.6 4.7 1.0 N A:ALA9 3.7 3.2 1.0 CG2 A:ILE6 3.7 12.6 1.0 CB A:ARG10 3.9 4.4 1.0 CA A:ARG10 3.9 5.0 1.0 N A:SER7 3.9 5.1 1.0 C A:ARG10 3.9 3.9 1.0 CA A:Q3S8 4.0 1.9 1.0 CA A:ILE11 4.0 7.4 1.0 C A:Q3S8 4.0 2.4 1.0 HG A:SER7 4.0 5.7 1.0 HB2 A:ALA9 4.0 2.6 1.0 CB A:ILE11 4.0 7.8 1.0 C A:ILE11 4.1 4.2 1.0 C02 A:Q3S8 4.2 4.5 1.0 HG21 A:ILE6 4.2 15.1 1.0 C A:ALA9 4.3 4.5 1.0 C A:SER7 4.4 2.3 1.0 CA A:ALA9 4.4 1.6 1.0 HA A:ILE6 4.4 9.6 1.0 CA A:SER7 4.5 3.7 1.0 HG2 A:ARG10 4.5 5.2 1.0 H012 A:Q3S8 4.5 5.5 1.0 CB A:SER7 4.5 2.5 1.0 HB3 A:ARG10 4.6 5.3 1.0 C A:ILE6 4.6 6.0 1.0 CG A:ARG10 4.7 4.3 1.0 CB A:ALA9 4.7 2.2 1.0 HG13 A:ILE11 4.7 17.5 1.0 HD13 A:ILE11 4.8 28.3 1.0 HG22 A:ILE11 4.8 10.3 1.0 HA A:ARG10 4.8 6.0 1.0 O A:Q3S8 4.8 3.4 1.0 HA A:Q3S8 4.9 2.3 1.0 HB3 A:SER7 4.9 3.0 1.0 HA A:ILE11 4.9 8.9 1.0 CA A:ILE6 4.9 8.0 1.0 HG3 A:ARG10 4.9 5.2 1.0 CB A:ILE6 4.9 11.2 1.0 C01 A:Q3S8 4.9 4.5 1.0 H021 A:Q3S8 4.9 5.4 1.0 CG1 A:ILE11 4.9 14.6 1.0

H.Yang, A.V.Pishenko, X.Li, J.S.Nowick. Design, Synthesis, and Study of Lactam and Ring-Expanded Analogues of Teixobactin. J.Org.Chem. 2019.
ISSN: ISSN 0022-3263
PubMed: 31746604
DOI: 10.1021/ACS.JOC.9B02631