Atomistry » Chlorine » PDB 7pps-7pw7 » 7pps
Atomistry »
  Chlorine »
    PDB 7pps-7pw7 »
      7pps »

Chlorine in PDB 7pps: Apo Fabb From Pseudomonas Aeruginosa with Single Point Mutation C161A

Enzymatic activity of Apo Fabb From Pseudomonas Aeruginosa with Single Point Mutation C161A

All present enzymatic activity of Apo Fabb From Pseudomonas Aeruginosa with Single Point Mutation C161A:
2.3.1.41;

Protein crystallography data

The structure of Apo Fabb From Pseudomonas Aeruginosa with Single Point Mutation C161A, PDB code: 7pps was solved by C.Georgiou, R.Brenk, V.Yadrykhinsky, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 47.19 / 1.30
Space group C 2 2 21
Cell size a, b, c (Å), α, β, γ (°) 74.228, 102.304, 188.774, 90, 90, 90
R / Rfree (%) 11.4 / 13.7

Other elements in 7pps:

The structure of Apo Fabb From Pseudomonas Aeruginosa with Single Point Mutation C161A also contains other interesting chemical elements:

Iodine (I) 11 atoms

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Apo Fabb From Pseudomonas Aeruginosa with Single Point Mutation C161A (pdb code 7pps). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 6 binding sites of Chlorine where determined in the Apo Fabb From Pseudomonas Aeruginosa with Single Point Mutation C161A, PDB code: 7pps:
Jump to Chlorine binding site number: 1; 2; 3; 4; 5; 6;

Chlorine binding site 1 out of 6 in 7pps

Go back to Chlorine Binding Sites List in 7pps
Chlorine binding site 1 out of 6 in the Apo Fabb From Pseudomonas Aeruginosa with Single Point Mutation C161A


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Apo Fabb From Pseudomonas Aeruginosa with Single Point Mutation C161A within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl519

b:25.6
occ:1.00
 O A:HOH766 2.9 34.5 1.0
O2 A:EDO502 3.1 14.4 1.0
NE2 A:HIS331 3.1 13.4 1.0
NE2 A:HIS296 3.2 16.4 1.0
CE1 A:HIS296 3.4 13.9 1.0
C2 A:EDO502 3.6 19.4 1.0
O A:PHE389 3.7 29.3 1.0
CB A:ALA161 3.8 17.8 1.0
CD2 A:HIS331 3.9 13.4 1.0
CG2 A:THR298 4.1 14.8 1.0
CE1 A:HIS331 4.2 12.7 1.0
CE1 A:PHE391 4.3 20.5 1.0
O A:HOH751 4.3 27.5 1.0
O A:HOH790 4.6 23.4 0.5
CD2 A:HIS296 4.6 16.0 1.0
CD1 A:PHE391 4.6 16.6 1.0
ND1 A:HIS296 4.7 16.0 1.0
CA A:GLY390 4.8 15.2 1.0
C A:PHE389 4.9 17.9 1.0
CZ A:PHE391 4.9 19.0 1.0

Chlorine binding site 2 out of 6 in 7pps

Go back to Chlorine Binding Sites List in 7pps
Chlorine binding site 2 out of 6 in the Apo Fabb From Pseudomonas Aeruginosa with Single Point Mutation C161A


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Apo Fabb From Pseudomonas Aeruginosa with Single Point Mutation C161A within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl520

b:57.7
occ:0.75
 NE A:ARG309 3.1 43.3 1.0
O A:HOH835 3.5 43.2 0.5
O A:SER271 3.6 36.3 1.0
N A:GLU273 3.8 23.8 1.0
CD A:ARG309 3.9 38.3 1.0
C A:GLY272 3.9 23.5 1.0
CA A:GLY272 4.0 26.4 1.0
NH2 A:ARG309 4.0 27.9 1.0
CZ A:ARG309 4.0 36.1 1.0
CG A:ARG309 4.3 32.8 1.0
CD1 A:ILE276 4.3 20.7 1.0
O A:HOH832 4.3 40.3 1.0
CA A:GLU273 4.5 22.8 1.0
O A:GLY272 4.6 22.1 1.0
C A:SER271 4.6 31.2 1.0
N A:GLY272 4.7 26.5 1.0
CB A:GLU273 4.8 26.4 1.0

Chlorine binding site 3 out of 6 in 7pps

Go back to Chlorine Binding Sites List in 7pps
Chlorine binding site 3 out of 6 in the Apo Fabb From Pseudomonas Aeruginosa with Single Point Mutation C161A


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of Apo Fabb From Pseudomonas Aeruginosa with Single Point Mutation C161A within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl512

b:18.6
occ:1.00
 O B:HOH792 2.8 25.8 1.0
O2 B:EDO503 3.0 14.3 1.0
NE2 B:HIS331 3.2 12.9 1.0
NE2 B:HIS296 3.3 20.2 1.0
C2 B:EDO503 3.4 18.9 1.0
CE1 B:HIS296 3.5 16.1 1.0
O B:PHE389 3.6 21.3 1.0
CD2 B:HIS331 3.9 13.6 1.0
CB B:ALA161 4.0 16.9 1.0
CG2 B:THR298 4.2 12.9 1.0
CE1 B:HIS331 4.3 12.4 1.0
CE1 B:PHE391 4.4 20.6 1.0
CD2 B:HIS296 4.6 16.8 1.0
CD1 B:PHE391 4.6 16.9 1.0
CA B:GLY390 4.6 12.7 1.0
C B:PHE389 4.7 14.8 1.0
O B:HOH766 4.8 40.8 1.0
ND1 B:HIS296 4.8 18.1 1.0
N B:PHE391 4.9 12.9 1.0
C1 B:EDO503 4.9 20.9 1.0

Chlorine binding site 4 out of 6 in 7pps

Go back to Chlorine Binding Sites List in 7pps
Chlorine binding site 4 out of 6 in the Apo Fabb From Pseudomonas Aeruginosa with Single Point Mutation C161A


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 4 of Apo Fabb From Pseudomonas Aeruginosa with Single Point Mutation C161A within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl513

b:26.8
occ:1.00
 O1 B:EDO503 2.6 20.7 1.0
O B:HOH825 2.9 35.5 1.0
C1 B:EDO503 3.3 20.9 1.0
O A:HOH702 3.5 14.0 1.0
CA B:GLY105 3.5 11.8 1.0
C B:GLY105 3.7 11.8 1.0
CA B:ALA160 3.8 11.3 1.0
O B:GLY105 3.9 15.9 1.0
CB A:MET136 3.9 12.4 1.0
CB B:ALA160 4.2 12.5 1.0
N B:GLY106 4.3 13.9 1.0
CZ B:PHE199 4.5 12.0 1.0
C B:ALA160 4.5 10.4 1.0
SD A:MET136 4.6 13.3 1.0
N B:ALA160 4.6 10.6 1.0
C2 B:EDO503 4.7 18.9 1.0
CG A:MET136 4.8 12.4 1.0
N B:GLY105 4.9 10.3 1.0
CB B:LEU333 4.9 10.6 1.0
CA A:MET136 4.9 11.3 1.0
O B:ALA160 5.0 11.2 1.0
CD1 B:LEU333 5.0 13.8 1.0

Chlorine binding site 5 out of 6 in 7pps

Go back to Chlorine Binding Sites List in 7pps
Chlorine binding site 5 out of 6 in the Apo Fabb From Pseudomonas Aeruginosa with Single Point Mutation C161A


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 5 of Apo Fabb From Pseudomonas Aeruginosa with Single Point Mutation C161A within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl514

b:32.3
occ:1.00
 O B:HOH738 3.4 21.9 1.0
CE B:LYS125 3.7 40.6 1.0
CD B:ARG126 4.0 24.9 1.0
CG B:ARG126 4.0 29.6 1.0
O B:HOH710 4.1 26.4 1.0
NZ B:LYS125 4.4 43.1 1.0
CB B:LYS125 4.4 21.6 1.0
O B:HOH782 4.6 25.0 1.0
CD B:LYS125 4.8 33.5 1.0

Chlorine binding site 6 out of 6 in 7pps

Go back to Chlorine Binding Sites List in 7pps
Chlorine binding site 6 out of 6 in the Apo Fabb From Pseudomonas Aeruginosa with Single Point Mutation C161A


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 6 of Apo Fabb From Pseudomonas Aeruginosa with Single Point Mutation C161A within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl515

b:37.7
occ:0.75
 O B:HOH843 2.6 39.7 1.0
OE2 B:GLU374 3.0 31.8 1.0
N B:ARG373 3.2 17.5 1.0
O B:HOH606 3.5 32.7 1.0
O B:ILE371 3.8 18.0 1.0
CB B:ARG373 3.8 20.5 1.0
CD B:GLU374 3.8 28.8 1.0
OE1 B:GLU374 4.0 33.9 1.0
CA B:LEU372 4.0 16.6 1.0
CG B:ARG373 4.1 20.4 1.0
CA B:ARG373 4.1 18.2 1.0
C B:LEU372 4.1 16.5 1.0
O B:HOH836 4.2 47.4 1.0
CD B:ARG373 4.3 22.4 1.0
O B:HOH672 4.5 27.5 1.0
N B:GLU374 4.5 19.4 1.0
C B:ILE371 4.7 16.0 1.0
C B:ARG373 4.7 19.1 1.0
N B:LEU372 4.9 15.6 1.0
CB B:LEU372 4.9 21.2 1.0

Reference:

C.Georgiou, R.Brenk, V.Yadrykhinsky. Crystal Structure of Pseudomonas Aeruginosa Fabb, A Template For Structure-Based Design For New Antibiotics To Be Published.
Page generated: Sun Jul 13 05:49:44 2025

Last articles

Fe in 2YXO
Fe in 2YRS
Fe in 2YXC
Fe in 2YNM
Fe in 2YVJ
Fe in 2YP1
Fe in 2YU2
Fe in 2YU1
Fe in 2YQB
Fe in 2YOO
© Copyright 2008-2020 by atomistry.com
Home   |    Site Map   |    Copyright   |    Contact us   |    Privacy