Chlorine in PDB 6p8s: Structure of P. Aeruginosa ATCC27853 HORMA1:HORMA2:Peptide 1 Complex

The structure of Structure of P. Aeruginosa ATCC27853 HORMA1:HORMA2:Peptide 1 Complex, PDB code: 6p8s was solved by Q.Ye, K.D.Corbett, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	39.20 / 2.00
Space group	C 2 2 21
Cell size a, b, c (Å), α, β, γ (°)	100.892, 124.539, 109.141, 90.00, 90.00, 90.00
R / Rfree (%)	19.1 / 22.7

The binding sites of Chlorine atom in the Structure of P. Aeruginosa ATCC27853 HORMA1:HORMA2:Peptide 1 Complex (pdb code 6p8s). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 3 binding sites of Chlorine where determined in the Structure of P. Aeruginosa ATCC27853 HORMA1:HORMA2:Peptide 1 Complex, PDB code: 6p8s:
Jump to Chlorine binding site number: 1; 2; 3;

Chlorine binding site 1 out of 3 in the Structure of P. Aeruginosa ATCC27853 HORMA1:HORMA2:Peptide 1 Complex


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Structure of P. Aeruginosa ATCC27853 HORMA1:HORMA2:Peptide 1 Complex within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl203 b:0.2 occ:1.00 HE2 A:HIS37 1.9 38.0 1.0 NE2 A:HIS37 2.7 31.6 1.0 O A:HOH366 2.8 31.9 1.0 HA A:LYS116 2.9 35.9 1.0 O A:HOH378 2.9 26.4 1.0 HH12 A:ARG41 3.1 39.4 1.0 HB2 A:LYS116 3.2 40.9 1.0 HG3 A:LYS116 3.5 45.0 1.0 NH1 A:ARG41 3.5 32.8 1.0 O A:TYR115 3.5 31.5 1.0 CE1 A:HIS37 3.6 29.7 1.0 HE1 A:HIS37 3.7 35.6 1.0 HH22 A:ARG41 3.7 44.2 1.0 CA A:LYS116 3.7 29.9 1.0 CD2 A:HIS37 3.7 30.6 1.0 CB A:LYS116 3.8 34.0 1.0 HH11 A:ARG41 3.9 39.4 1.0 HD2 A:HIS37 3.9 36.8 1.0 CZ A:ARG41 3.9 34.2 1.0 NH2 A:ARG41 4.0 36.9 1.0 H A:LEU117 4.0 31.9 1.0 CG A:LYS116 4.1 37.5 1.0 HD2 A:LYS116 4.2 49.2 1.0 O A:HOH357 4.2 41.6 1.0 HG3 A:ARG41 4.3 31.7 1.0 O A:HOH409 4.4 33.9 1.0 C A:TYR115 4.4 29.4 1.0 O A:HOH388 4.5 49.2 1.0 N A:LYS116 4.5 29.3 1.0 HH21 A:ARG41 4.6 44.2 1.0 N A:LEU117 4.6 26.6 1.0 O A:HOH320 4.7 23.2 1.0 HB3 A:LYS116 4.7 40.9 1.0 CD A:LYS116 4.7 41.0 1.0 C A:LYS116 4.7 27.6 1.0 O A:HOH361 4.8 22.7 1.0 ND1 A:HIS37 4.8 31.0 1.0 NE A:ARG41 4.9 31.6 1.0 CG A:HIS37 4.9 27.6 1.0 HG2 A:LYS116 4.9 45.0 1.0

Chlorine binding site 2 out of 3 in the Structure of P. Aeruginosa ATCC27853 HORMA1:HORMA2:Peptide 1 Complex


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Structure of P. Aeruginosa ATCC27853 HORMA1:HORMA2:Peptide 1 Complex within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl204 b:0.5 occ:1.00 HD21 A:LEU30 3.0 40.6 1.0 HE2 A:LYS100 3.3 72.8 1.0 O A:HOH312 3.3 45.6 1.0 HD11 A:LEU30 3.5 38.4 1.0 HG3 C:GLU109 3.7 51.0 1.0 CD2 A:LEU30 3.9 33.8 1.0 HZ3 A:LYS100 4.1 75.3 1.0 CE A:LYS100 4.2 60.6 1.0 HD23 A:LEU29 4.2 36.9 1.0 HZ1 A:LYS100 4.2 75.3 1.0 HG A:LEU30 4.2 38.4 1.0 O C:HOH239 4.3 26.7 1.0 HD23 A:LEU30 4.3 40.6 1.0 CD1 A:LEU30 4.3 32.0 1.0 NZ A:LYS100 4.4 62.7 1.0 CG A:LEU30 4.4 32.0 1.0 HD22 A:LEU30 4.5 40.6 1.0 CG C:GLU109 4.6 42.5 1.0 HD3 A:LYS100 4.7 72.0 1.0 HE3 A:LYS100 4.7 72.8 1.0 HG2 C:GLU109 4.7 51.0 1.0 OE2 C:GLU109 4.7 44.4 1.0 HD21 A:LEU29 4.8 36.9 1.0 HD13 A:LEU30 4.8 38.4 1.0 HB3 A:ASP26 4.9 31.9 1.0 CD2 A:LEU29 4.9 30.7 1.0 HD12 A:LEU30 5.0 38.4 1.0

Chlorine binding site 3 out of 3 in the Structure of P. Aeruginosa ATCC27853 HORMA1:HORMA2:Peptide 1 Complex


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of Structure of P. Aeruginosa ATCC27853 HORMA1:HORMA2:Peptide 1 Complex within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl201 b:0.4 occ:1.00 HE2 B:HIS37 2.2 32.8 1.0 O B:HOH362 2.8 26.7 1.0 HH12 B:ARG41 2.8 40.6 1.0 O F:HOH104 3.0 29.2 1.0 HA B:LYS116 3.0 30.7 1.0 NE2 B:HIS37 3.0 27.3 1.0 O B:HOH384 3.2 45.7 1.0 HG3 B:LYS116 3.2 37.1 1.0 NH1 B:ARG41 3.3 33.8 1.0 HB2 B:LYS116 3.6 33.8 1.0 HH11 B:ARG41 3.7 40.6 1.0 HH22 B:ARG41 3.8 42.5 1.0 CA B:LYS116 3.8 25.5 1.0 O B:TYR115 3.9 23.2 1.0 H B:LEU117 3.9 32.7 1.0 CD2 B:HIS37 3.9 26.4 1.0 HD2 B:HIS37 3.9 31.7 1.0 CB B:LYS116 3.9 28.1 1.0 CG B:LYS116 4.0 30.9 1.0 CE1 B:HIS37 4.0 27.6 1.0 CZ B:ARG41 4.1 33.9 1.0 NH2 B:ARG41 4.2 35.4 1.0 HE1 B:HIS37 4.2 33.1 1.0 HG3 B:ARG41 4.4 31.1 1.0 HG2 B:LYS116 4.5 37.1 1.0 N B:LEU117 4.5 27.2 1.0 O B:HOH328 4.6 23.9 1.0 O B:HOH391 4.6 49.8 1.0 O B:HOH367 4.6 30.6 1.0 C B:TYR115 4.7 22.3 1.0 C B:LYS116 4.8 26.4 1.0 N B:LYS116 4.8 23.1 1.0 HH21 B:ARG41 4.9 42.5 1.0 HB3 B:LYS116 4.9 33.8 1.0 HD2 B:LYS116 5.0 41.1 1.0

Q.Ye, R.K.Lau, I.T.Mathews, E.A.Birkholz, J.D.Watrous, C.S.Azimi, J.Pogliano, M.Jain, K.D.Corbett. Horma Domain Proteins and A TRIP13-Like Atpase Regulate Bacterial Cgas-Like Enzymes to Mediate Bacteriophage Immunity To Be Published.