Chlorine in PDB 8u78: Structure of A N-Me-D-GLN4,LYS10-Teixobactin Analogue

The structure of Structure of A N-Me-D-GLN4,LYS10-Teixobactin Analogue, PDB code: 8u78 was solved by J.S.Nowick, H.Yang, A.G.Kreutzer, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	24.88 / 1.50
Space group	P 43
Cell size a, b, c (Å), α, β, γ (°)	24.88, 24.88, 106.315, 90, 90, 90
R / Rfree (%)	15.4 / 18.3

Pages:

>>> Page 1 <<< Page 2, Binding sites: 11 - 14;

Binding sites:

The binding sites of Chlorine atom in the Structure of A N-Me-D-GLN4,LYS10-Teixobactin Analogue (pdb code 8u78). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 14 binding sites of Chlorine where determined in the Structure of A N-Me-D-GLN4,LYS10-Teixobactin Analogue, PDB code: 8u78:
Jump to Chlorine binding site number: 1; 2; 3; 4; 5; 6; 7; 8; 9; 10;

Chlorine binding site 1 out of 14 in the Structure of A N-Me-D-GLN4,LYS10-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,LYS10-Teixobactin Analogue within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl101 b:10.0 occ:1.00 H A:SER7 2.3 11.1 1.0 H A:ILE11 2.4 14.0 1.0 H A:LYS10 2.5 14.3 1.0 HB2 A:LYS10 2.8 14.8 1.0 HG A:SER7 2.9 14.5 1.0 HD11 D:ILE11 2.9 25.2 1.0 O A:HOH201 2.9 30.8 1.0 HA A:ILE6 3.1 13.3 1.0 N A:SER7 3.2 9.3 1.0 H A:ALA9 3.2 12.2 1.0 N A:ILE11 3.2 11.7 1.0 N A:LYS10 3.3 11.9 1.0 HB A:ILE11 3.3 18.2 1.0 N A:DTH8 3.4 9.6 1.0 HG23 A:ILE6 3.4 17.4 1.0 O A:HOH204 3.4 19.5 1.0 OG1 A:DTH8 3.6 11.7 1.0 N A:ALA9 3.6 10.2 1.0 CB A:LYS10 3.6 12.4 1.0 OG A:SER7 3.7 12.1 1.0 CD1 D:ILE11 3.8 21.0 1.0 CA A:LYS10 3.9 12.7 1.0 HB3 A:ALA9 3.9 15.7 1.0 CA A:ILE6 3.9 11.1 1.0 C A:ILE6 4.0 12.1 1.0 CA A:SER7 4.0 9.1 1.0 C A:LYS10 4.0 19.1 1.0 CB A:ILE11 4.1 15.2 1.0 CA A:ILE11 4.1 13.2 1.0 HG3 A:LYS10 4.1 18.4 1.0 C A:SER7 4.1 9.8 1.0 C A:DTH8 4.1 11.1 1.0 CA A:DTH8 4.1 10.3 1.0 HG13 D:ILE11 4.2 21.9 1.0 HD12 D:ILE11 4.2 25.2 1.0 HG12 A:ILE11 4.2 28.7 1.0 HG12 A:ILE6 4.3 16.6 1.0 CG2 A:ILE6 4.3 14.5 1.0 CB A:SER7 4.3 8.7 1.0 C A:ALA9 4.3 15.6 1.0 HB3 A:LYS10 4.3 14.8 1.0 CG A:LYS10 4.4 15.4 1.0 HD3 A:LYS10 4.4 26.3 1.0 C A:ILE11 4.4 16.9 1.0 CA A:ALA9 4.4 13.0 1.0 HG12 D:ILE11 4.4 21.9 1.0 CG1 D:ILE11 4.4 18.3 1.0 O A:28J5 4.4 12.9 1.0 HD13 D:ILE11 4.4 25.2 1.0 CB A:DTH8 4.5 13.9 1.0 HB3 A:SER7 4.5 10.4 1.0 CB A:ALA9 4.6 13.1 1.0 CB A:ILE6 4.6 13.0 1.0 CG1 A:ILE11 4.6 23.9 1.0 CD A:LYS10 4.7 21.9 1.0 HG22 A:ILE6 4.8 17.4 1.0 HD2 A:LYS10 4.8 26.3 1.0 HA A:LYS10 4.8 15.3 1.0 HG23 A:DTH8 4.8 17.0 1.0 HG21 A:ILE6 4.9 17.4 1.0 HA A:SER7 4.9 10.9 1.0 CG1 A:ILE6 4.9 13.8 1.0 HA A:ILE11 5.0 15.8 1.0 HG13 A:ILE11 5.0 28.7 1.0 HB2 A:ALA9 5.0 15.7 1.0

Chlorine binding site 2 out of 14 in the Structure of A N-Me-D-GLN4,LYS10-Teixobactin Analogue


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Structure of A N-Me-D-GLN4,LYS10-Teixobactin Analogue within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl102 b:42.1 occ:1.00 O D:HOH205 2.8 23.8 1.0 O A:HOH203 3.0 22.4 1.0 HE3 A:LYS10 3.0 30.6 1.0 HB1 D:HJV4 3.1 19.0 1.0 HB2 D:HJV4 3.4 19.0 1.0 CL D:CL102 3.6 50.3 1.0 HG2 D:HJV4 3.6 31.1 1.0 CB D:HJV4 3.7 15.9 1.0 CE A:LYS10 3.9 25.5 1.0 HZ2 A:LYS10 4.0 27.9 1.0 HZ3 A:LYS10 4.1 27.9 1.0 CG D:HJV4 4.1 25.9 1.0 NZ A:LYS10 4.2 23.3 1.0 HG2 A:LYS10 4.3 18.4 1.0 HE2 A:LYS10 4.4 30.6 1.0 O D:HJV4 4.6 17.1 1.0 HD2 A:LYS10 4.8 26.3 1.0 HG1 D:HJV4 4.8 31.1 1.0 CD A:LYS10 4.8 21.9 1.0 O D:HOH204 4.9 33.6 1.0 CG A:LYS10 4.9 15.4 1.0

Chlorine binding site 3 out of 14 in the Structure of A N-Me-D-GLN4,LYS10-Teixobactin Analogue


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of Structure of A N-Me-D-GLN4,LYS10-Teixobactin Analogue within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl103 b:48.2 occ:1.00 H10 A:HJV4 3.0 44.5 1.0 O A:HOH207 3.1 27.0 1.0 HZ2 D:LYS10 3.4 19.5 1.0 NE2 A:HJV4 3.6 37.1 1.0 HZ3 D:LYS10 3.6 19.5 1.0 HZ1 D:LYS10 3.8 19.5 1.0 NZ D:LYS10 3.8 16.2 1.0 OE1 A:HJV4 3.9 32.9 1.0 CD A:HJV4 4.1 33.6 1.0 H11 A:HJV4 4.2 44.5 1.0 O D:HOH202 4.9 27.9 1.0

Chlorine binding site 4 out of 14 in the Structure of A N-Me-D-GLN4,LYS10-Teixobactin Analogue


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 4 of Structure of A N-Me-D-GLN4,LYS10-Teixobactin Analogue within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl101 b:12.2 occ:1.00 H B:SER7 2.4 11.9 1.0 H B:ILE11 2.5 17.6 1.0 H B:LYS10 2.6 23.1 1.0 HZ3 H:LYS10 2.6 46.0 1.0 HD3 H:LYS10 2.8 25.9 1.0 HG B:SER7 3.0 19.5 1.0 HA B:ILE6 3.1 12.5 1.0 HB2 B:LYS10 3.1 26.9 1.0 HB B:ILE11 3.2 19.1 1.0 N B:SER7 3.2 10.0 1.0 HG23 B:ILE6 3.3 15.1 1.0 N B:ILE11 3.3 14.7 1.0 N B:DTH8 3.3 10.8 1.0 N B:LYS10 3.4 19.2 1.0 NZ H:LYS10 3.4 38.3 1.0 H B:ALA9 3.4 17.4 1.0 CD H:LYS10 3.6 21.6 1.0 HD12 B:ILE11 3.6 24.3 1.0 OG1 B:DTH8 3.7 13.8 1.0 OG B:SER7 3.7 16.2 1.0 HD2 H:LYS10 3.7 25.9 1.0 HB3 B:ALA9 3.7 22.0 1.0 N B:ALA9 3.8 14.5 1.0 HZ2 H:LYS10 3.8 46.0 1.0 HD13 B:ILE11 3.8 24.3 1.0 CE H:LYS10 3.9 23.1 1.0 CA B:ILE6 3.9 10.4 1.0 HE2 H:LYS10 3.9 27.7 1.0 CB B:LYS10 3.9 22.4 1.0 CA B:LYS10 4.0 15.8 1.0 CB B:ILE11 4.0 15.9 1.0 HZ1 H:LYS10 4.0 46.0 1.0 C B:ILE6 4.1 11.7 1.0 CA B:ILE11 4.1 14.2 1.0 CA B:SER7 4.1 12.5 1.0 CD1 B:ILE11 4.1 20.2 1.0 C B:LYS10 4.1 16.3 1.0 C B:DTH8 4.1 15.3 1.0 CA B:DTH8 4.2 11.8 1.0 CG2 B:ILE6 4.2 12.6 1.0 C B:SER7 4.2 11.6 1.0 HG12 B:ILE6 4.2 13.2 1.0 C B:ALA9 4.4 28.9 1.0 HB3 B:LYS10 4.4 26.9 1.0 CA B:ALA9 4.4 19.9 1.0 CB B:SER7 4.5 13.7 1.0 C B:ILE11 4.5 10.8 1.0 CB B:ALA9 4.5 18.3 1.0 CB B:ILE6 4.5 11.7 1.0 O B:28J5 4.5 14.4 1.0 CB B:DTH8 4.6 12.8 1.0 CG1 B:ILE11 4.7 19.8 1.0 HG22 B:ILE6 4.7 15.1 1.0 HG21 B:ILE6 4.7 15.1 1.0 HB3 B:SER7 4.8 16.5 1.0 HG3 B:LYS10 4.8 39.7 1.0 HB3 H:LYS10 4.8 26.2 1.0 HE3 H:LYS10 4.8 27.7 1.0 CG1 B:ILE6 4.9 11.0 1.0 HG23 B:DTH8 4.9 19.1 1.0 CG H:LYS10 4.9 21.2 1.0 HB2 B:ALA9 4.9 22.0 1.0 HD3 B:LYS10 4.9 42.2 1.0 HB2 H:LYS10 4.9 26.2 1.0 CG B:LYS10 4.9 33.1 1.0 HA B:LYS10 4.9 19.0 1.0 O B:DTH8 5.0 19.4 1.0 HD11 B:ILE11 5.0 24.3 1.0 HA B:SER7 5.0 15.0 1.0 N B:ILE6 5.0 10.0 1.0

Chlorine binding site 5 out of 14 in the Structure of A N-Me-D-GLN4,LYS10-Teixobactin Analogue


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 5 of Structure of A N-Me-D-GLN4,LYS10-Teixobactin Analogue within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl102 b:65.8 occ:1.00 H28 B:28J5 2.4 34.9 1.0 H29 B:28J5 2.9 34.9 1.0 CD1 B:28J5 3.0 29.1 1.0 H30 B:28J5 3.3 34.9 1.0 O B:HJV4 3.6 23.8 1.0 HA B:28J5 3.6 19.1 1.0 HG21 B:ILE2 3.6 20.9 1.0 HG22 B:ILE2 3.7 20.9 1.0 CG2 B:ILE2 4.1 17.4 1.0 CG1 B:28J5 4.3 23.5 1.0 HG23 B:ILE2 4.5 20.9 1.0 CA B:28J5 4.5 15.9 1.0 H27 B:28J5 4.5 28.2 1.0 C B:HJV4 4.6 17.1 1.0 H22 B:28J5 4.8 23.9 1.0 CB B:28J5 4.8 19.9 1.0

Chlorine binding site 6 out of 14 in the Structure of A N-Me-D-GLN4,LYS10-Teixobactin Analogue


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 6 of Structure of A N-Me-D-GLN4,LYS10-Teixobactin Analogue within 5.0Å range: probe atom residue distance (Å) B Occ C:Cl101 b:10.9 occ:1.00 H C:SER7 2.4 12.9 1.0 H C:ILE11 2.4 14.8 1.0 H C:LYS10 2.5 13.8 1.0 HZ2 G:LYS10 2.8 33.0 1.0 HD2 G:LYS10 2.8 25.4 1.0 HG C:SER7 3.0 17.6 1.0 HA C:ILE6 3.0 12.8 1.0 HB3 C:LYS10 3.0 15.1 1.0 HG23 C:ILE6 3.1 17.5 1.0 N C:SER7 3.2 10.7 1.0 N C:ILE11 3.2 12.4 1.0 N C:DTH8 3.3 14.1 1.0 H C:ALA9 3.3 14.0 1.0 N C:LYS10 3.3 11.5 1.0 HB C:ILE11 3.4 15.8 1.0 OG1 C:DTH8 3.6 13.4 1.0 NZ G:LYS10 3.6 27.5 1.0 CD G:LYS10 3.6 21.2 1.0 HE3 G:LYS10 3.7 34.2 1.0 N C:ALA9 3.7 11.7 1.0 OG C:SER7 3.7 14.7 1.0 HG12 C:ILE11 3.8 22.2 1.0 CE G:LYS10 3.8 28.5 1.0 CA C:ILE6 3.8 10.7 1.0 HG12 C:ILE6 3.8 17.0 1.0 CB C:LYS10 3.8 12.6 1.0 HD3 G:LYS10 3.9 25.4 1.0 CA C:LYS10 3.9 11.3 1.0 C C:ILE6 4.0 11.3 1.0 CG2 C:ILE6 4.0 14.6 1.0 CA C:SER7 4.0 11.4 1.0 CB C:ILE11 4.1 13.2 1.0 HZ3 G:LYS10 4.1 33.0 1.0 CA C:ILE11 4.1 13.5 1.0 C C:LYS10 4.1 12.2 1.0 C C:DTH8 4.1 11.2 1.0 HB3 C:ALA9 4.1 17.3 1.0 CA C:DTH8 4.1 10.7 1.0 HZ1 G:LYS10 4.1 33.0 1.0 C C:SER7 4.1 14.0 1.0 HB2 C:LYS10 4.3 15.1 1.0 CB C:ILE6 4.4 11.7 1.0 C C:ALA9 4.4 12.5 1.0 CG1 C:ILE11 4.4 18.5 1.0 C C:ILE11 4.4 12.5 1.0 CB C:DTH8 4.4 13.6 1.0 CA C:ALA9 4.4 14.1 1.0 O C:28J5 4.4 14.7 1.0 CB C:SER7 4.5 10.9 1.0 O C:HOH205 4.5 29.5 1.0 CG1 C:ILE6 4.6 14.2 1.0 HG22 C:ILE6 4.6 17.5 1.0 HG21 C:ILE6 4.6 17.5 1.0 HB3 C:SER7 4.7 13.1 1.0 HG23 C:DTH8 4.8 16.6 1.0 CB C:ALA9 4.8 14.4 1.0 HG13 C:ILE11 4.8 22.2 1.0 HE2 G:LYS10 4.8 34.2 1.0 CG G:LYS10 4.8 30.1 1.0 HB3 G:LYS10 4.8 20.2 1.0 HA C:LYS10 4.9 13.6 1.0 HA C:SER7 4.9 13.7 1.0 HG3 G:LYS10 4.9 36.1 1.0 O C:DTH8 4.9 11.4 1.0 HA C:ILE11 4.9 16.2 1.0 N C:ILE6 5.0 11.4 1.0 HA C:DTH8 5.0 12.8 1.0 HG13 C:ILE6 5.0 17.0 1.0 CG C:LYS10 5.0 13.8 1.0

Chlorine binding site 7 out of 14 in the Structure of A N-Me-D-GLN4,LYS10-Teixobactin Analogue


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 7 of Structure of A N-Me-D-GLN4,LYS10-Teixobactin Analogue within 5.0Å range: probe atom residue distance (Å) B Occ C:Cl102 b:30.2 occ:1.00 O C:HOH208 2.5 37.7 1.0 O C:HOH206 2.6 20.9 1.0 HG1 C:HJV4 2.8 31.7 1.0 HG2 C:HJV4 3.2 31.7 1.0 CG C:HJV4 3.4 26.4 1.0 HA C:HJV4 3.4 21.8 1.0 HE2 G:LYS10 3.9 34.2 1.0 HB1 C:HJV4 4.1 22.5 1.0 CB C:HJV4 4.1 18.8 1.0 CA C:HJV4 4.2 18.1 1.0 HG2 G:LYS10 4.5 36.1 1.0 HB1 G:ALA9 4.5 33.2 1.0 HZ3 G:LYS10 4.5 33.0 1.0 CD C:HJV4 4.7 52.8 1.0 CE G:LYS10 4.8 28.5 1.0 O G:ALA9 4.9 29.4 1.0 HZ1 G:LYS10 5.0 33.0 1.0 NZ G:LYS10 5.0 27.5 1.0

Chlorine binding site 8 out of 14 in the Structure of A N-Me-D-GLN4,LYS10-Teixobactin Analogue


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 8 of Structure of A N-Me-D-GLN4,LYS10-Teixobactin Analogue within 5.0Å range: probe atom residue distance (Å) B Occ D:Cl101 b:11.3 occ:1.00 HZ1 A:LYS10 2.2 27.9 1.0 H D:SER7 2.3 13.5 1.0 H D:ILE11 2.4 15.1 1.0 H D:LYS10 2.4 14.4 1.0 HG D:SER7 2.9 16.6 1.0 HA D:ILE6 3.0 15.7 1.0 NZ A:LYS10 3.1 23.3 1.0 N D:SER7 3.1 11.3 1.0 HG2 D:LYS10 3.1 25.1 1.0 HB2 D:LYS10 3.2 16.6 1.0 N D:ILE11 3.2 12.6 1.0 N D:LYS10 3.2 12.0 1.0 HZ3 A:LYS10 3.3 27.9 1.0 HB D:ILE11 3.4 15.7 1.0 N D:DTH8 3.4 10.1 1.0 HG23 D:ILE6 3.4 20.8 1.0 H D:ALA9 3.4 16.4 1.0 HD3 A:LYS10 3.5 26.3 1.0 HZ2 A:LYS10 3.5 27.9 1.0 OG D:SER7 3.6 13.8 1.0 OG1 D:DTH8 3.7 11.5 1.0 N D:ALA9 3.7 13.7 1.0 CB D:LYS10 3.7 13.8 1.0 CA D:ILE6 3.8 13.1 1.0 CA D:LYS10 3.8 12.0 1.0 CG D:LYS10 3.8 20.9 1.0 CE A:LYS10 3.9 25.5 1.0 C D:ILE6 4.0 13.9 1.0 HB3 D:ALA9 4.0 14.3 1.0 CA D:SER7 4.0 11.7 1.0 HG13 D:ILE11 4.0 21.9 1.0 C D:LYS10 4.0 15.5 1.0 CD A:LYS10 4.1 21.9 1.0 HD12 D:ILE11 4.1 25.2 1.0 CB D:ILE11 4.1 13.1 1.0 HE2 A:LYS10 4.1 30.6 1.0 CA D:ILE11 4.1 13.0 1.0 C D:DTH8 4.1 13.9 1.0 HD2 A:LYS10 4.1 26.3 1.0 C D:SER7 4.2 10.5 1.0 HG3 D:LYS10 4.2 25.1 1.0 CA D:DTH8 4.2 12.8 1.0 C D:ALA9 4.3 15.2 1.0 CG2 D:ILE6 4.3 17.4 1.0 CB D:SER7 4.3 14.2 1.0 CA D:ALA9 4.4 10.9 1.0 C D:ILE11 4.4 13.1 1.0 HG12 D:ILE6 4.4 23.8 1.0 CG1 D:ILE11 4.4 18.3 1.0 O D:28J5 4.6 16.1 1.0 CB D:ILE6 4.6 12.7 1.0 CB D:DTH8 4.6 12.3 1.0 HB3 D:SER7 4.6 17.1 1.0 HB3 D:LYS10 4.6 16.6 1.0 HG22 D:ILE6 4.7 20.8 1.0 CB D:ALA9 4.7 11.9 1.0 CD1 D:ILE11 4.7 21.0 1.0 HA D:LYS10 4.8 14.4 1.0 HE3 A:LYS10 4.8 30.6 1.0 HG23 D:DTH8 4.9 19.5 1.0 O D:DTH8 4.9 15.4 1.0 HA D:SER7 4.9 14.1 1.0 N D:ILE6 4.9 13.6 1.0 O D:HOH204 4.9 33.6 1.0 HG21 D:ILE6 4.9 20.8 1.0 HA D:ILE11 5.0 15.6 1.0

Chlorine binding site 9 out of 14 in the Structure of A N-Me-D-GLN4,LYS10-Teixobactin Analogue


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 9 of Structure of A N-Me-D-GLN4,LYS10-Teixobactin Analogue within 5.0Å range: probe atom residue distance (Å) B Occ D:Cl102 b:50.3 occ:1.00 OE1 D:HJV4 3.3 39.4 1.0 HG3 A:LYS10 3.3 18.4 1.0 HB1 A:ALA9 3.4 15.7 1.0 CL A:CL102 3.6 42.1 1.0 HG2 A:LYS10 3.7 18.4 1.0 HG2 D:HJV4 3.8 31.1 1.0 CG A:LYS10 3.9 15.4 1.0 HB1 D:HJV4 3.9 19.0 1.0 HB3 A:ALA9 4.0 15.7 1.0 HE3 A:LYS10 4.0 30.6 1.0 CD D:HJV4 4.1 25.9 1.0 CB A:ALA9 4.2 13.1 1.0 HD2 A:LYS10 4.2 26.3 1.0 CG D:HJV4 4.3 25.9 1.0 CD A:LYS10 4.5 21.9 1.0 CB D:HJV4 4.6 15.9 1.0 O A:HOH203 4.7 22.4 1.0 CE A:LYS10 4.8 25.5 1.0 HB2 A:ALA9 4.8 15.7 1.0 C A:ALA9 4.8 15.6 1.0 O A:ALA9 5.0 17.6 1.0 N A:LYS10 5.0 11.9 1.0

Chlorine binding site 10 out of 14 in the Structure of A N-Me-D-GLN4,LYS10-Teixobactin Analogue


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 10 of Structure of A N-Me-D-GLN4,LYS10-Teixobactin Analogue within 5.0Å range: probe atom residue distance (Å) B Occ E:Cl101 b:11.7 occ:1.00 HZ3 F:LYS10 2.3 44.8 1.0 H E:SER7 2.4 14.2 1.0 H E:ILE11 2.4 17.4 1.0 H E:LYS10 2.4 18.7 1.0 HB2 E:LYS10 2.8 14.9 1.0 HB E:ILE6 3.1 18.4 1.0 NZ F:LYS10 3.1 37.3 1.0 N E:SER7 3.2 11.9 1.0 N E:LYS10 3.2 15.6 1.0 N E:ILE11 3.2 14.5 1.0 N E:DTH8 3.3 14.0 1.0 HA E:ILE6 3.3 17.2 1.0 H E:ALA9 3.3 18.2 1.0 HB E:ILE11 3.3 21.2 1.0 HZ2 F:LYS10 3.6 44.8 1.0 HZ1 F:LYS10 3.6 44.8 1.0 OG E:SER7 3.6 19.8 1.0 CB E:LYS10 3.6 12.4 1.0 N E:ALA9 3.7 15.2 1.0 OG1 E:DTH8 3.7 12.1 1.0 HE2 F:LYS10 3.8 42.4 1.0 HE3 F:LYS10 3.8 42.4 1.0 CA E:LYS10 3.8 14.3 1.0 CE F:LYS10 3.8 35.3 1.0 CA E:ILE6 3.8 14.3 1.0 CB E:ILE6 3.9 15.3 1.0 HG22 E:ILE6 3.9 21.3 1.0 HG3 E:LYS10 4.0 25.8 1.0 C E:ILE6 4.0 14.8 1.0 HB3 E:ALA9 4.0 29.6 1.0 C E:LYS10 4.0 12.7 1.0 CA E:SER7 4.0 13.8 1.0 C E:SER7 4.1 16.3 1.0 CA E:DTH8 4.1 14.5 1.0 C E:DTH8 4.1 16.0 1.0 CA E:ILE11 4.1 14.3 1.0 CB E:ILE11 4.1 17.6 1.0 HG E:SER7 4.2 23.7 1.0 C E:ALA9 4.3 16.8 1.0 CB E:SER7 4.3 19.0 1.0 HB3 E:LYS10 4.4 14.9 1.0 CG E:LYS10 4.4 21.5 1.0 CG2 E:ILE6 4.4 17.7 1.0 CA E:ALA9 4.4 16.3 1.0 C E:ILE11 4.5 13.6 1.0 CB E:DTH8 4.5 11.3 1.0 HB3 E:SER7 4.6 22.8 1.0 HG21 E:ILE6 4.6 21.3 1.0 HG23 E:DTH8 4.6 16.7 1.0 HG12 F:ILE11 4.7 38.4 1.0 CB E:ALA9 4.7 24.6 1.0 HA E:LYS10 4.7 17.2 1.0 HD11 F:ILE11 4.8 53.3 1.0 HD3 E:LYS10 4.8 21.2 1.0 HG13 E:ILE11 4.8 32.6 1.0 HD13 E:ILE11 4.9 33.9 1.0 HA E:SER7 4.9 16.6 1.0 HD11 E:ILE11 4.9 33.9 1.0 CG1 E:ILE11 4.9 27.2 1.0 O E:DTH8 5.0 19.1 1.0

H.Yang, A.G.Kreutzer, J.S.Nowick. Structure of A N-Me-D-GLN4,LYS10-Teixobactin Analogue To Be Published.