Chlorine in PDB 7ptg: Pseudomonas Aeruginosa Dna Gyrase B 24KDA Atpase Subdomain Complexed with EBL2888

All present enzymatic activity of Pseudomonas Aeruginosa Dna Gyrase B 24KDA Atpase Subdomain Complexed with EBL2888:
5.6.2.2;

The structure of Pseudomonas Aeruginosa Dna Gyrase B 24KDA Atpase Subdomain Complexed with EBL2888, PDB code: 7ptg was solved by A.E.Cotman, A.Zega, N.Zidar, J.Ilas, T.Tomasic, L.P.Masic, J.E.A.Mundy, C.E.M.Stevenson, N.Burton, D.M.Lawson, A.Maxwell, D.Kikelj, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	41.89 / 2.20
Space group	P 1 21 1
Cell size a, b, c (Å), α, β, γ (°)	52.572, 47.865, 75.287, 90, 93.46, 90
R / Rfree (%)	19.4 / 23.6

The binding sites of Chlorine atom in the Pseudomonas Aeruginosa Dna Gyrase B 24KDA Atpase Subdomain Complexed with EBL2888 (pdb code 7ptg). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 4 binding sites of Chlorine where determined in the Pseudomonas Aeruginosa Dna Gyrase B 24KDA Atpase Subdomain Complexed with EBL2888, PDB code: 7ptg:
Jump to Chlorine binding site number: 1; 2; 3; 4;

Chlorine binding site 1 out of 4 in the Pseudomonas Aeruginosa Dna Gyrase B 24KDA Atpase Subdomain Complexed with EBL2888


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Pseudomonas Aeruginosa Dna Gyrase B 24KDA Atpase Subdomain Complexed with EBL2888 within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl301 b:24.9 occ:1.00 CL1 A:80S301 0.0 24.9 1.0 C21 A:80S301 1.7 23.6 1.0 C22 A:80S301 2.7 23.5 1.0 C3 A:80S301 2.7 23.4 1.0 N2 A:80S301 3.2 23.5 1.0 CL2 A:80S301 3.4 24.6 1.0 C4 A:80S301 3.4 23.1 1.0 O A:HOH437 3.6 24.3 1.0 CD1 A:ILE80 3.7 19.6 1.0 C2 A:80S301 3.9 23.4 1.0 N1 A:80S301 3.9 23.3 1.0 OD1 A:ASN48 3.9 23.8 1.0 CB A:ASN48 3.9 21.9 1.0 CG1 A:ILE80 3.9 20.5 1.0 CG A:ASN48 4.1 22.1 1.0 C5 A:80S301 4.3 23.9 1.0 CG2 A:ILE96 4.3 26.2 1.0 N3 A:80S301 4.6 24.6 1.0 O1 A:80S301 4.6 23.5 1.0 C11 A:80S301 4.7 33.6 1.0 CG1 A:VAL122 4.7 26.3 1.0 O A:HOH426 4.7 20.5 1.0 C12 A:80S301 4.8 35.3 1.0

Chlorine binding site 2 out of 4 in the Pseudomonas Aeruginosa Dna Gyrase B 24KDA Atpase Subdomain Complexed with EBL2888


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Pseudomonas Aeruginosa Dna Gyrase B 24KDA Atpase Subdomain Complexed with EBL2888 within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl301 b:24.6 occ:1.00 CL2 A:80S301 0.0 24.6 1.0 C22 A:80S301 1.7 23.5 1.0 C2 A:80S301 2.7 23.4 1.0 C21 A:80S301 2.8 23.6 1.0 C1 A:80S301 3.2 23.1 1.0 CL1 A:80S301 3.4 24.9 1.0 CG2 A:VAL122 3.6 25.3 1.0 CB A:ASN48 3.6 21.9 1.0 N1 A:80S301 3.8 23.3 1.0 C3 A:80S301 3.9 23.4 1.0 CB A:VAL122 4.0 25.6 1.0 CG A:ASN48 4.0 22.1 1.0 CG2 A:VAL169 4.1 22.0 1.0 CG1 A:VAL122 4.2 26.3 1.0 CG1 A:VAL45 4.2 22.2 1.0 ND2 A:ASN48 4.3 22.2 1.0 O A:VAL45 4.5 21.9 1.0 OD1 A:ASN48 4.7 23.8 1.0 CD1 A:ILE80 4.7 19.6 1.0 CA A:VAL45 4.8 22.5 1.0 SD A:MET97 4.9 33.2 1.0 CG2 A:THR167 4.9 23.7 1.0

Chlorine binding site 3 out of 4 in the Pseudomonas Aeruginosa Dna Gyrase B 24KDA Atpase Subdomain Complexed with EBL2888


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of Pseudomonas Aeruginosa Dna Gyrase B 24KDA Atpase Subdomain Complexed with EBL2888 within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl301 b:29.1 occ:1.00 CL1 B:80S301 0.0 29.1 1.0 C21 B:80S301 1.7 28.4 1.0 C22 B:80S301 2.8 28.1 1.0 C3 B:80S301 2.8 28.2 1.0 N2 B:80S301 3.1 30.6 1.0 CD1 B:ILE80 3.3 26.5 1.0 C4 B:80S301 3.4 29.4 1.0 CL2 B:80S301 3.5 29.2 1.0 CB B:ASN48 3.8 30.8 1.0 OD1 B:ASN48 3.8 33.2 1.0 CG1 B:ILE80 3.8 26.8 1.0 N1 B:80S301 3.9 28.0 1.0 C2 B:80S301 3.9 27.7 1.0 CG B:ASN48 3.9 32.1 1.0 CG2 B:ILE96 4.2 32.3 1.0 C5 B:80S301 4.2 31.4 1.0 CG1 B:VAL122 4.5 31.7 1.0 O1 B:80S301 4.6 29.6 1.0 N3 B:80S301 4.6 31.5 1.0 ND2 B:ASN48 4.8 32.9 1.0

Chlorine binding site 4 out of 4 in the Pseudomonas Aeruginosa Dna Gyrase B 24KDA Atpase Subdomain Complexed with EBL2888


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 4 of Pseudomonas Aeruginosa Dna Gyrase B 24KDA Atpase Subdomain Complexed with EBL2888 within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl301 b:29.2 occ:1.00 CL2 B:80S301 0.0 29.2 1.0 C22 B:80S301 1.7 28.1 1.0 C2 B:80S301 2.7 27.7 1.0 C21 B:80S301 2.8 28.4 1.0 C1 B:80S301 3.2 26.9 1.0 CL1 B:80S301 3.5 29.1 1.0 CG2 B:VAL122 3.6 30.9 1.0 N1 B:80S301 3.9 28.0 1.0 CG1 B:VAL45 3.9 26.6 1.0 CG2 B:VAL169 3.9 28.1 1.0 C3 B:80S301 3.9 28.2 1.0 CB B:ASN48 4.0 30.8 1.0 CB B:VAL122 4.1 31.1 1.0 O B:VAL45 4.3 27.8 1.0 CG B:ASN48 4.3 32.1 1.0 CG1 B:VAL122 4.3 31.7 1.0 ND2 B:ASN48 4.4 32.9 1.0 CA B:VAL45 4.5 27.8 1.0 CB B:VAL45 4.6 27.1 1.0 CD1 B:ILE80 4.7 26.5 1.0 C B:VAL45 4.9 27.4 1.0 CB B:VAL169 4.9 27.6 1.0 CG2 B:VAL45 5.0 27.2 1.0

A.E.Cotman, A.Zega, N.Zidar, J.Ilas, T.Tomasic, L.P.Masic, J.E.A.Mundy, C.E.M.Stevenson, N.Burton, D.M.Lawson, A.Maxwell, D.Kikelj. Pseudomonas Aeruginosa Dna Gyrase B 24KDA Atpase Subdomain Complexed with EBL2888 To Be Published.