Atomistry » Chlorine » PDB 6ggn-6gop » 6goa
Atomistry »
  Chlorine »
    PDB 6ggn-6gop »
      6goa »

Chlorine in PDB 6goa: Structural Basis For Oxa-48 Dimerization - R189A Mutant

Enzymatic activity of Structural Basis For Oxa-48 Dimerization - R189A Mutant

All present enzymatic activity of Structural Basis For Oxa-48 Dimerization - R189A Mutant:
3.5.2.6;

Protein crystallography data

The structure of Structural Basis For Oxa-48 Dimerization - R189A Mutant, PDB code: 6goa was solved by B.A.Lund, A.M.Thomassen, H.K.S.Leiros, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 24.67 / 2.55
Space group P 1 21 1
Cell size a, b, c (Å), α, β, γ (°) 107.726, 85.545, 125.805, 90.00, 90.08, 90.00
R / Rfree (%) 24 / 27.5

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Structural Basis For Oxa-48 Dimerization - R189A Mutant (pdb code 6goa). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 8 binding sites of Chlorine where determined in the Structural Basis For Oxa-48 Dimerization - R189A Mutant, PDB code: 6goa:
Jump to Chlorine binding site number: 1; 2; 3; 4; 5; 6; 7; 8;

Chlorine binding site 1 out of 8 in 6goa

Go back to Chlorine Binding Sites List in 6goa
Chlorine binding site 1 out of 8 in the Structural Basis For Oxa-48 Dimerization - R189A Mutant


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Structural Basis For Oxa-48 Dimerization - R189A Mutant within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl301

b:38.9
occ:1.00
HH12 D:ARG206 2.3 26.0 1.0
HH12 A:ARG206 2.4 26.8 1.0
HH22 D:ARG206 2.5 27.4 1.0
HH22 A:ARG206 2.5 28.7 1.0
HD22 D:LEU196 3.1 45.8 1.0
HD22 A:LEU196 3.1 40.1 1.0
NH1 D:ARG206 3.1 22.0 1.0
NH1 A:ARG206 3.2 22.2 1.0
NH2 D:ARG206 3.3 22.4 1.0
NH2 A:ARG206 3.3 23.4 1.0
HA A:GLN193 3.6 32.5 1.0
CZ D:ARG206 3.6 21.8 1.0
HG3 A:GLN193 3.7 32.6 1.0
CZ A:ARG206 3.7 23.4 1.0
HA D:GLN193 3.7 62.2 1.0
HG3 D:GLN193 3.8 90.9 1.0
HH11 D:ARG206 3.8 26.0 1.0
HH11 A:ARG206 3.9 26.8 1.0
HB2 A:LEU196 3.9 36.0 1.0
HH21 D:ARG206 4.0 27.4 1.0
HB2 D:LEU196 4.0 48.8 1.0
HH21 A:ARG206 4.0 28.7 1.0
CD2 D:LEU196 4.0 37.6 1.0
CD2 A:LEU196 4.0 32.9 1.0
HD13 D:LEU196 4.1 46.8 1.0
HD13 A:LEU196 4.3 39.9 1.0
HD23 A:LEU196 4.4 40.1 1.0
HD21 D:LEU196 4.5 45.8 1.0
HD23 D:LEU196 4.5 45.8 1.0
CA A:GLN193 4.5 27.7 1.0
HD21 A:LEU196 4.5 40.1 1.0
CG A:GLN193 4.6 28.9 1.0
HB2 A:GLN193 4.6 32.3 1.0
CA D:GLN193 4.7 51.3 1.0
CG D:GLN193 4.7 75.2 1.0
CB A:LEU196 4.8 29.5 1.0
HB2 D:GLN193 4.8 35.7 1.0
CG D:LEU196 4.8 39.3 1.0
CB A:GLN193 4.8 28.3 1.0
CG A:LEU196 4.8 31.7 1.0
CB D:LEU196 4.8 40.2 1.0
CD1 D:LEU196 4.9 38.5 1.0
CD1 A:LEU196 5.0 32.7 1.0
CB D:GLN193 5.0 32.4 1.0
NE D:ARG206 5.0 22.9 1.0
HG2 A:GLN193 5.0 32.6 1.0
O A:GLN193 5.0 28.9 1.0

Chlorine binding site 2 out of 8 in 6goa

Go back to Chlorine Binding Sites List in 6goa
Chlorine binding site 2 out of 8 in the Structural Basis For Oxa-48 Dimerization - R189A Mutant


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Structural Basis For Oxa-48 Dimerization - R189A Mutant within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl301

b:49.3
occ:1.00
HH22 B:ARG250 2.5 33.9 1.0
NH2 B:ARG250 3.3 30.9 1.0
OG1 B:THR209 3.5 42.3 1.0
HB2 B:TYR211 3.5 48.4 1.0
HH12 B:ARG250 3.7 36.5 1.0
HH21 B:ARG250 3.8 33.9 1.0
HB B:THR209 3.8 51.4 1.0
HB3 B:TYR211 4.1 48.4 1.0
HG B:SER70 4.1 37.4 1.0
HB3 B:SER118 4.1 55.7 1.0
HG1 B:THR209 4.1 51.4 1.0
HB2 B:SER70 4.1 38.3 1.0
OG B:SER118 4.2 51.1 1.0
HA2 B:GLY210 4.2 54.8 1.0
HB2 B:SER118 4.2 55.7 1.0
CB B:THR209 4.2 42.3 1.0
CB B:TYR211 4.3 39.8 1.0
CZ B:ARG250 4.3 31.6 1.0
NH1 B:ARG250 4.3 33.0 1.0
CB B:SER118 4.4 45.9 1.0
N B:GLY210 4.5 45.8 1.0
C B:GLY210 4.5 43.3 1.0
HG B:SER118 4.5 62.0 1.0
O B:HOH412 4.5 7.9 1.0
N B:TYR211 4.5 41.8 1.0
CA B:GLY210 4.6 45.2 1.0
C B:THR209 4.6 44.8 1.0
H B:GLY210 4.6 55.6 1.0
H B:TYR211 4.6 50.7 1.0
HZ1 B:LYS208 4.7 39.8 1.0
OG B:SER70 4.7 31.3 1.0
CB B:SER70 4.8 31.4 1.0
O B:GLY210 4.8 43.0 1.0
O B:THR209 4.9 45.7 1.0
HB3 B:SER70 4.9 38.3 1.0
HD22 B:LEU247 4.9 46.8 1.0
HD2 B:TYR211 5.0 53.2 1.0
HZ3 B:LYS208 5.0 39.8 1.0
HD13 B:LEU247 5.0 53.4 1.0

Chlorine binding site 3 out of 8 in 6goa

Go back to Chlorine Binding Sites List in 6goa
Chlorine binding site 3 out of 8 in the Structural Basis For Oxa-48 Dimerization - R189A Mutant


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of Structural Basis For Oxa-48 Dimerization - R189A Mutant within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Cl301

b:37.3
occ:1.00
HH22 C:ARG206 2.4 33.4 1.0
HH12 C:ARG206 2.4 29.3 1.0
HH12 B:ARG206 2.6 29.2 1.0
HH22 B:ARG206 2.9 30.7 1.0
NH2 C:ARG206 3.1 28.1 1.0
NH1 C:ARG206 3.1 26.2 1.0
NH1 B:ARG206 3.4 24.0 1.0
HG3 B:GLN193 3.4 40.6 1.0
HD22 C:LEU196 3.4 29.7 1.0
HA B:GLN193 3.5 33.7 1.0
CZ C:ARG206 3.5 26.9 1.0
HD22 B:LEU196 3.6 31.0 1.0
HA C:GLN193 3.6 37.8 1.0
NH2 B:ARG206 3.7 25.0 1.0
HH21 C:ARG206 3.8 33.4 1.0
HH11 C:ARG206 3.8 29.3 1.0
HG3 C:GLN193 3.9 43.0 1.0
CZ B:ARG206 4.0 25.1 1.0
HH11 B:ARG206 4.0 29.2 1.0
HB2 C:LEU196 4.2 27.8 1.0
HB2 B:LEU196 4.2 30.4 1.0
CG B:GLN193 4.3 33.3 1.0
CD2 C:LEU196 4.4 26.8 1.0
CA B:GLN193 4.4 27.6 1.0
HB2 B:GLN193 4.4 37.7 1.0
HH21 B:ARG206 4.4 30.7 1.0
HD13 C:LEU196 4.5 28.4 1.0
CD2 B:LEU196 4.5 25.9 1.0
CA C:GLN193 4.6 31.0 1.0
CB B:GLN193 4.6 30.9 1.0
HB2 C:GLN193 4.6 41.8 1.0
HG2 B:GLN193 4.7 40.6 1.0
HD13 B:LEU196 4.7 31.4 1.0
HD23 C:LEU196 4.7 29.7 1.0
CG C:GLN193 4.8 35.3 1.0
HD23 B:LEU196 4.8 31.0 1.0
HD21 C:LEU196 4.8 29.7 1.0
NE C:ARG206 4.8 26.6 1.0
CB C:GLN193 4.9 34.3 1.0
O B:GLN193 4.9 29.2 1.0

Chlorine binding site 4 out of 8 in 6goa

Go back to Chlorine Binding Sites List in 6goa
Chlorine binding site 4 out of 8 in the Structural Basis For Oxa-48 Dimerization - R189A Mutant


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 4 of Structural Basis For Oxa-48 Dimerization - R189A Mutant within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Cl302

b:51.6
occ:1.00
HH12 C:ARG250 2.3 43.6 1.0
HH22 C:ARG250 2.5 42.5 1.0
NH1 C:ARG250 3.1 35.9 1.0
NH2 C:ARG250 3.3 34.9 1.0
CZ C:ARG250 3.6 35.0 1.0
HG1 C:THR209 3.7 46.6 1.0
HB2 C:TYR211 3.8 44.3 1.0
HH11 C:ARG250 3.8 43.6 1.0
HD13 C:LEU247 3.9 41.8 1.0
HH21 C:ARG250 4.0 42.5 1.0
OG1 C:THR209 4.1 38.3 1.0
HD22 C:LEU247 4.3 41.2 1.0
HG C:SER118 4.3 53.1 1.0
HB C:THR209 4.4 43.6 1.0
HD2 C:TYR211 4.4 48.6 1.0
HB3 C:TYR211 4.5 44.3 1.0
CB C:TYR211 4.6 36.4 1.0
HB2 C:SER118 4.7 49.7 1.0
CB C:THR209 4.8 35.8 1.0
HB3 C:LEU247 4.8 40.5 1.0
CD1 C:LEU247 4.9 34.3 1.0
NE C:ARG250 5.0 34.0 1.0

Chlorine binding site 5 out of 8 in 6goa

Go back to Chlorine Binding Sites List in 6goa
Chlorine binding site 5 out of 8 in the Structural Basis For Oxa-48 Dimerization - R189A Mutant


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 5 of Structural Basis For Oxa-48 Dimerization - R189A Mutant within 5.0Å range:
probe atom residue distance (Å) B Occ
E:Cl301

b:54.5
occ:1.00
HH12 E:ARG206 2.3 39.5 1.0
HH12 H:ARG206 2.5 46.7 1.0
HH22 H:ARG206 2.5 46.4 1.0
HH22 E:ARG206 2.6 42.9 1.0
NH1 E:ARG206 3.1 35.6 1.0
HD22 E:LEU196 3.2 41.8 1.0
NH1 H:ARG206 3.2 41.5 1.0
NH2 H:ARG206 3.2 41.3 1.0
NH2 E:ARG206 3.3 38.4 1.0
HA E:GLN193 3.4 63.1 1.0
HD22 H:LEU196 3.4 51.5 1.0
HG3 E:GLN193 3.4 57.0 1.0
CZ H:ARG206 3.7 54.5 1.0
CZ E:ARG206 3.7 36.6 1.0
HA H:GLN193 3.7 52.4 1.0
HG3 H:GLN193 3.7 51.4 1.0
HH11 E:ARG206 3.8 39.5 1.0
HH11 H:ARG206 3.9 46.7 1.0
HH21 H:ARG206 3.9 46.4 1.0
HB2 E:LEU196 4.0 40.2 1.0
HH21 E:ARG206 4.0 42.9 1.0
CD2 E:LEU196 4.2 36.3 1.0
HD13 E:LEU196 4.2 43.5 1.0
HB2 H:LEU196 4.3 67.0 1.0
CA E:GLN193 4.3 52.0 1.0
CG E:GLN193 4.3 47.0 1.0
HB2 E:GLN193 4.4 61.1 1.0
CD2 H:LEU196 4.4 45.5 1.0
HD23 E:LEU196 4.6 41.8 1.0
CB E:GLN193 4.6 50.4 1.0
HD13 H:LEU196 4.6 67.0 1.0
CA H:GLN193 4.6 43.2 1.0
CG H:GLN193 4.6 45.5 1.0
HB2 H:GLN193 4.6 49.9 1.0
HD21 E:LEU196 4.6 41.8 1.0
HD23 H:LEU196 4.7 51.5 1.0
HG2 E:GLN193 4.7 57.0 1.0
CB E:LEU196 4.8 33.5 1.0
O E:GLN193 4.8 37.7 1.0
CB H:GLN193 4.9 44.3 1.0
CG E:LEU196 4.9 34.9 1.0
HD21 H:LEU196 4.9 51.5 1.0
CD1 E:LEU196 4.9 35.7 1.0
NE H:ARG206 5.0 53.3 1.0
NE E:ARG206 5.0 36.4 1.0

Chlorine binding site 6 out of 8 in 6goa

Go back to Chlorine Binding Sites List in 6goa
Chlorine binding site 6 out of 8 in the Structural Basis For Oxa-48 Dimerization - R189A Mutant


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 6 of Structural Basis For Oxa-48 Dimerization - R189A Mutant within 5.0Å range:
probe atom residue distance (Å) B Occ
G:Cl301

b:30.4
occ:1.00
HH12 F:ARG206 2.4 25.6 1.0
HH12 G:ARG206 2.4 38.5 1.0
HH22 G:ARG206 2.4 29.6 1.0
HH22 F:ARG206 2.9 27.3 1.0
NH1 G:ARG206 3.1 31.6 1.0
HD22 F:LEU196 3.2 36.9 1.0
NH1 F:ARG206 3.2 23.1 1.0
NH2 G:ARG206 3.2 27.3 1.0
HD22 G:LEU196 3.4 34.1 1.0
HA F:GLN193 3.5 39.5 1.0
HG3 F:GLN193 3.5 33.5 1.0
NH2 F:ARG206 3.6 24.5 1.0
CZ G:ARG206 3.6 31.0 1.0
HG3 G:GLN193 3.7 44.2 1.0
HA G:GLN193 3.7 36.1 1.0
HH11 F:ARG206 3.8 25.6 1.0
HH11 G:ARG206 3.8 38.5 1.0
CZ F:ARG206 3.8 23.6 1.0
HH21 G:ARG206 3.9 29.6 1.0
HB2 F:LEU196 4.0 35.9 1.0
CD2 F:LEU196 4.1 30.2 1.0
HB2 G:LEU196 4.2 37.4 1.0
HH21 F:ARG206 4.3 27.3 1.0
HD13 F:LEU196 4.3 35.4 1.0
HD13 G:LEU196 4.3 33.4 1.0
CD2 G:LEU196 4.3 29.7 1.0
HD23 F:LEU196 4.4 36.9 1.0
CG F:GLN193 4.4 27.4 1.0
CA F:GLN193 4.4 32.4 1.0
HB2 F:GLN193 4.5 37.3 1.0
CG G:GLN193 4.6 36.3 1.0
HB2 G:GLN193 4.6 41.5 1.0
CA G:GLN193 4.6 29.6 1.0
HD21 F:LEU196 4.6 36.9 1.0
CB F:GLN193 4.7 30.5 1.0
HD23 G:LEU196 4.7 34.1 1.0
HD21 G:LEU196 4.8 34.1 1.0
CB G:GLN193 4.8 34.0 1.0
CB F:LEU196 4.8 29.4 1.0
HG2 F:GLN193 4.8 33.5 1.0
CG F:LEU196 4.9 29.3 1.0
NE G:ARG206 4.9 30.0 1.0
O F:GLN193 5.0 36.7 1.0

Chlorine binding site 7 out of 8 in 6goa

Go back to Chlorine Binding Sites List in 6goa
Chlorine binding site 7 out of 8 in the Structural Basis For Oxa-48 Dimerization - R189A Mutant


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 7 of Structural Basis For Oxa-48 Dimerization - R189A Mutant within 5.0Å range:
probe atom residue distance (Å) B Occ
G:Cl302

b:52.6
occ:1.00
HG1 G:THR209 2.6 40.8 1.0
HH22 G:ARG250 2.6 45.8 1.0
HG G:SER118 3.2 42.7 1.0
HA2 G:GLY210 3.2 42.2 1.0
OG1 G:THR209 3.3 33.5 1.0
NH2 G:ARG250 3.4 37.7 1.0
HB2 G:SER70 3.5 52.8 1.0
HB G:THR209 3.6 40.1 1.0
HB2 G:TYR211 3.7 44.7 1.0
HG G:SER70 3.7 53.4 1.0
N G:GLY210 3.7 34.2 1.0
CA G:GLY210 3.8 34.6 1.0
HH21 G:ARG250 3.8 45.8 1.0
C G:THR209 3.9 34.5 1.0
C G:GLY210 3.9 35.3 1.0
HH12 G:ARG250 3.9 43.9 1.0
OG G:SER118 3.9 35.1 1.0
H G:TYR211 3.9 44.8 1.0
HB3 G:TYR211 4.0 44.7 1.0
N G:TYR211 4.0 36.8 1.0
CB G:THR209 4.0 32.9 1.0
O G:THR209 4.0 27.6 1.0
H G:GLY210 4.1 41.7 1.0
HZ3 G:LYS208 4.1 34.5 1.0
CB G:SER70 4.2 43.5 1.0
CB G:TYR211 4.2 36.7 1.0
HB3 G:SER118 4.3 41.6 1.0
HZ1 G:LYS208 4.3 34.5 1.0
OG G:SER70 4.3 44.0 1.0
HB2 G:SER118 4.4 41.6 1.0
HB3 G:SER70 4.4 52.8 1.0
CZ G:ARG250 4.4 36.4 1.0
CB G:SER118 4.5 34.1 1.0
O G:GLY210 4.5 29.6 1.0
NH1 G:ARG250 4.5 36.4 1.0
HZ2 G:LYS208 4.5 34.5 1.0
NZ G:LYS208 4.5 28.2 1.0
CA G:THR209 4.6 33.1 1.0
HA3 G:GLY210 4.7 42.2 1.0
CA G:TYR211 4.7 37.6 1.0
O G:HOH407 4.9 17.6 1.0

Chlorine binding site 8 out of 8 in 6goa

Go back to Chlorine Binding Sites List in 6goa
Chlorine binding site 8 out of 8 in the Structural Basis For Oxa-48 Dimerization - R189A Mutant


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 8 of Structural Basis For Oxa-48 Dimerization - R189A Mutant within 5.0Å range:
probe atom residue distance (Å) B Occ
H:Cl301

b:58.7
occ:1.00
HH22 H:ARG250 2.2 61.0 1.0
HG1 H:THR209 2.9 75.8 1.0
NH2 H:ARG250 3.0 53.5 1.0
HH12 H:ARG250 3.2 95.4 1.0
HB2 H:TYR211 3.3 70.4 1.0
OG1 H:THR209 3.4 62.6 1.0
HG H:SER118 3.4 76.3 1.0
HH21 H:ARG250 3.5 61.0 1.0
HB H:THR209 3.6 74.6 1.0
NH1 H:ARG250 3.8 79.0 1.0
CZ H:ARG250 3.9 54.4 1.0
HB3 H:TYR211 3.9 70.4 1.0
HA2 H:GLY210 3.9 55.9 1.0
O H:HOH415 3.9 41.0 1.0
O H:HOH401 4.0 38.9 1.0
CB H:THR209 4.0 61.7 1.0
CB H:TYR211 4.0 58.1 1.0
N H:GLY210 4.1 86.4 1.0
HB2 H:SER70 4.2 91.2 1.0
C H:GLY210 4.2 51.0 1.0
OG H:SER118 4.2 66.3 1.0
N H:TYR211 4.2 52.5 1.0
CA H:GLY210 4.3 49.2 1.0
HB2 H:SER118 4.3 76.0 1.0
HB3 H:SER118 4.3 76.0 1.0
H H:GLY210 4.3 0.4 1.0
HG H:SER70 4.3 93.1 1.0
C H:THR209 4.3 47.6 1.0
H H:TYR211 4.3 59.8 1.0
HZ1 H:LYS208 4.5 59.7 1.0
CB H:SER118 4.5 66.0 1.0
O H:GLY210 4.6 55.0 1.0
HH11 H:ARG250 4.6 95.4 1.0
O H:THR209 4.6 47.3 1.0
CA H:TYR211 4.8 56.2 1.0
HZ2 H:LYS208 4.8 59.7 1.0
HD22 H:LEU247 4.8 84.1 1.0
HD2 H:TYR211 4.8 70.5 1.0
CA H:THR209 4.9 47.2 1.0
CB H:SER70 4.9 75.5 1.0
OG H:SER70 4.9 77.0 1.0
HZ3 H:LYS208 4.9 59.7 1.0
NZ H:LYS208 4.9 49.2 1.0

Reference:

B.A.Lund, A.M.Thomassen, B.H.B.Nesheim, T.J.O.Carlsen, J.Isaksson, T.Christopeit, H.S.Leiros. The Biological Assembly of Oxa-48 Reveals A Dimer Interface with High Charge Complementarity and Very High Affinity. Febs J. V. 285 4214 2018.
ISSN: ISSN 1742-4658
PubMed: 30153368
DOI: 10.1111/FEBS.14643
Page generated: Sun Jul 28 00:03:39 2024

Last articles

Zn in 2YRC
Zn in 2YQP
Zn in 2YR2
Zn in 2YQL
Zn in 2YPT
Zn in 2YPA
Zn in 2YPU
Zn in 2YNW
Zn in 2YNT
Zn in 2YNV
© Copyright 2008-2020 by atomistry.com
Home   |    Site Map   |    Copyright   |    Contact us   |    Privacy