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Chlorine in PDB 3oow: Octameric Structure of the Phosphoribosylaminoimidazole Carboxylase Catalytic Subunit From Francisella Tularensis Subsp. Tularensis Schu S4.

Enzymatic activity of Octameric Structure of the Phosphoribosylaminoimidazole Carboxylase Catalytic Subunit From Francisella Tularensis Subsp. Tularensis Schu S4.

All present enzymatic activity of Octameric Structure of the Phosphoribosylaminoimidazole Carboxylase Catalytic Subunit From Francisella Tularensis Subsp. Tularensis Schu S4.:
4.1.1.21;

Protein crystallography data

The structure of Octameric Structure of the Phosphoribosylaminoimidazole Carboxylase Catalytic Subunit From Francisella Tularensis Subsp. Tularensis Schu S4., PDB code: 3oow was solved by E.V.Filippova, Z.Wawrzak, M.Kudritska, A.Edwards, A.Savchenko, F.W.Anderson, Center For Structural Genomics Of Infectious Diseases(Csgid), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 77.09 / 1.75
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 88.560, 96.300, 128.620, 90.00, 90.00, 90.00
R / Rfree (%) 16.8 / 20.5

Chlorine Binding Sites:

Pages:

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

Binding sites:

The binding sites of Chlorine atom in the Octameric Structure of the Phosphoribosylaminoimidazole Carboxylase Catalytic Subunit From Francisella Tularensis Subsp. Tularensis Schu S4. (pdb code 3oow). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 14 binding sites of Chlorine where determined in the Octameric Structure of the Phosphoribosylaminoimidazole Carboxylase Catalytic Subunit From Francisella Tularensis Subsp. Tularensis Schu S4., PDB code: 3oow:
Jump to Chlorine binding site number: 1; 2; 3; 4; 5; 6; 7; 8; 9; 10;

Chlorine binding site 1 out of 14 in 3oow

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Chlorine binding site 1 out of 14 in the Octameric Structure of the Phosphoribosylaminoimidazole Carboxylase Catalytic Subunit From Francisella Tularensis Subsp. Tularensis Schu S4.


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Octameric Structure of the Phosphoribosylaminoimidazole Carboxylase Catalytic Subunit From Francisella Tularensis Subsp. Tularensis Schu S4. within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl164

b:29.9
occ:1.00
O A:HOH182 2.7 27.4 1.0
O A:HOH203 2.9 28.0 1.0
N A:HIS70 3.1 20.0 1.0
N A:LEU71 3.3 18.0 1.0
CE1 A:HIS40 3.7 21.8 1.0
CB A:ALA39 3.8 20.1 1.0
O A:ALA68 3.8 20.4 1.0
CB A:ALA65 3.8 20.2 1.0
CA A:ALA69 3.9 20.1 1.0
CA A:HIS70 3.9 19.7 1.0
C A:ALA69 3.9 21.1 1.0
CB A:LEU71 3.9 16.7 1.0
C A:HIS70 4.0 19.1 1.0
ND1 A:HIS40 4.0 21.3 1.0
CA A:LEU71 4.1 17.9 1.0
CB A:HIS70 4.2 20.5 1.0
O3 A:PO4166 4.2 44.3 1.0
O4 A:PO4167 4.4 42.5 1.0
O4 A:PO4166 4.5 42.3 1.0
NE2 A:HIS40 4.6 23.6 1.0
C A:ALA68 4.7 20.0 1.0
N A:ALA39 4.7 19.8 1.0
N A:ALA69 4.8 18.8 1.0
CA A:ALA39 4.8 20.2 1.0
CG A:HIS70 4.9 19.0 1.0
CB A:ALA69 4.9 18.8 1.0
CG A:HIS40 5.0 22.1 1.0
P A:PO4166 5.0 47.6 1.0

Chlorine binding site 2 out of 14 in 3oow

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Chlorine binding site 2 out of 14 in the Octameric Structure of the Phosphoribosylaminoimidazole Carboxylase Catalytic Subunit From Francisella Tularensis Subsp. Tularensis Schu S4.


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Octameric Structure of the Phosphoribosylaminoimidazole Carboxylase Catalytic Subunit From Francisella Tularensis Subsp. Tularensis Schu S4. within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl165

b:37.2
occ:1.00
O A:HOH250 2.7 32.4 1.0
N A:LYS45 3.2 22.1 1.0
CA A:THR42 3.4 21.1 1.0
C A:THR42 3.5 20.9 1.0
CB A:THR42 3.6 22.3 1.0
N A:ASP44 3.6 22.0 1.0
CB A:ASP44 3.7 24.4 1.0
O A:THR42 3.8 21.6 1.0
CB A:LYS45 3.8 24.0 1.0
CA A:ASP44 4.0 22.4 1.0
C A:ASP44 4.0 22.5 1.0
N A:PRO43 4.0 19.9 1.0
CA A:LYS45 4.0 23.0 1.0
CG2 A:THR42 4.3 22.8 1.0
CG2 F:THR151 4.3 26.6 1.0
CD A:PRO43 4.4 20.4 1.0
CD1 F:LEU155 4.4 36.6 1.0
C A:PRO43 4.6 20.8 1.0
CD2 F:LEU155 4.6 33.7 1.0
CG A:ASP44 4.6 27.2 1.0
OG1 A:THR42 4.7 21.0 1.0
OD2 A:ASP44 4.8 31.6 1.0
N A:THR42 4.8 21.0 1.0
O A:ARG41 4.8 22.9 1.0
CA A:PRO43 4.9 19.7 1.0
CG F:LEU155 4.9 30.2 1.0

Chlorine binding site 3 out of 14 in 3oow

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Chlorine binding site 3 out of 14 in the Octameric Structure of the Phosphoribosylaminoimidazole Carboxylase Catalytic Subunit From Francisella Tularensis Subsp. Tularensis Schu S4.


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of Octameric Structure of the Phosphoribosylaminoimidazole Carboxylase Catalytic Subunit From Francisella Tularensis Subsp. Tularensis Schu S4. within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl164

b:33.8
occ:1.00
O B:HOH205 2.7 28.9 1.0
N B:LYS45 3.2 22.1 1.0
CA B:THR42 3.4 19.6 1.0
C B:THR42 3.5 19.3 1.0
N B:ASP44 3.5 20.9 1.0
CB B:THR42 3.6 19.9 1.0
O B:THR42 3.7 20.5 1.0
CB B:ASP44 3.8 23.0 1.0
CB B:LYS45 3.9 23.2 1.0
CA B:ASP44 3.9 22.3 1.0
N B:PRO43 4.0 18.4 1.0
C B:ASP44 4.0 21.2 1.0
CA B:LYS45 4.1 21.6 1.0
CD2 C:LEU155 4.1 23.6 1.0
CG2 C:THR151 4.3 21.5 1.0
CG2 B:THR42 4.3 21.1 1.0
C B:PRO43 4.5 19.7 1.0
CD B:PRO43 4.5 19.6 1.0
CD1 C:LEU155 4.5 26.8 1.0
CG B:ASP44 4.5 27.1 1.0
OD2 B:ASP44 4.6 36.6 1.0
CG C:LEU155 4.7 26.6 1.0
OG1 B:THR42 4.7 23.6 1.0
N B:THR42 4.8 20.1 1.0
CA B:PRO43 4.8 18.4 1.0
O B:ARG41 4.8 22.1 1.0

Chlorine binding site 4 out of 14 in 3oow

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Chlorine binding site 4 out of 14 in the Octameric Structure of the Phosphoribosylaminoimidazole Carboxylase Catalytic Subunit From Francisella Tularensis Subsp. Tularensis Schu S4.


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 4 of Octameric Structure of the Phosphoribosylaminoimidazole Carboxylase Catalytic Subunit From Francisella Tularensis Subsp. Tularensis Schu S4. within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Cl164

b:29.4
occ:1.00
O C:HOH187 2.8 25.2 1.0
N C:HIS70 3.0 17.9 1.0
O C:HOH192 3.1 28.1 1.0
N C:LEU71 3.1 16.8 1.0
CB C:ALA65 3.7 19.8 1.0
CE1 C:HIS40 3.7 22.8 1.0
O C:ALA68 3.8 20.1 1.0
CB C:LEU71 3.8 15.7 1.0
CA C:ALA69 3.9 17.3 1.0
C C:ALA69 3.9 18.8 1.0
CA C:HIS70 3.9 17.8 1.0
C C:HIS70 3.9 17.3 1.0
CB C:ALA39 4.0 18.7 1.0
CA C:LEU71 4.1 16.4 1.0
ND1 C:HIS40 4.1 24.8 1.0
CB C:HIS70 4.2 18.7 1.0
O3 C:PO4167 4.2 62.3 1.0
O3 C:PO4168 4.3 51.4 1.0
NE2 C:HIS40 4.5 24.3 1.0
C C:ALA68 4.7 18.7 1.0
N C:ALA69 4.8 16.5 1.0
CG C:HIS70 4.8 19.7 1.0
CB C:ALA69 4.9 17.3 1.0
N C:ALA39 4.9 19.8 1.0

Chlorine binding site 5 out of 14 in 3oow

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Chlorine binding site 5 out of 14 in the Octameric Structure of the Phosphoribosylaminoimidazole Carboxylase Catalytic Subunit From Francisella Tularensis Subsp. Tularensis Schu S4.


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 5 of Octameric Structure of the Phosphoribosylaminoimidazole Carboxylase Catalytic Subunit From Francisella Tularensis Subsp. Tularensis Schu S4. within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Cl165

b:34.9
occ:1.00
O C:HOH301 2.5 30.9 1.0
N C:LYS45 3.2 22.1 1.0
CA C:THR42 3.4 20.6 1.0
N C:ASP44 3.5 22.2 1.0
C C:THR42 3.5 20.1 1.0
CB C:ASP44 3.5 24.9 1.0
CB C:THR42 3.6 21.3 1.0
O C:THR42 3.7 19.4 1.0
CB C:LYS45 3.8 24.2 1.0
CA C:ASP44 3.8 23.8 1.0
C C:ASP44 4.0 23.4 1.0
N C:PRO43 4.0 20.2 1.0
CA C:LYS45 4.1 23.6 1.0
CD2 A:LEU155 4.2 27.8 1.0
CG2 C:THR42 4.3 21.7 1.0
CG2 A:THR151 4.3 24.6 1.0
CG C:ASP44 4.4 29.4 1.0
CD1 A:LEU155 4.4 28.0 1.0
CD C:PRO43 4.4 21.3 1.0
C C:PRO43 4.5 21.6 1.0
OD2 C:ASP44 4.5 34.5 1.0
CG A:LEU155 4.7 28.3 1.0
OG1 C:THR42 4.8 24.4 1.0
N C:THR42 4.8 21.6 1.0
O C:ARG41 4.8 22.1 1.0
CA C:PRO43 4.8 20.9 1.0

Chlorine binding site 6 out of 14 in 3oow

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Chlorine binding site 6 out of 14 in the Octameric Structure of the Phosphoribosylaminoimidazole Carboxylase Catalytic Subunit From Francisella Tularensis Subsp. Tularensis Schu S4.


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 6 of Octameric Structure of the Phosphoribosylaminoimidazole Carboxylase Catalytic Subunit From Francisella Tularensis Subsp. Tularensis Schu S4. within 5.0Å range:
probe atom residue distance (Å) B Occ
D:Cl164

b:31.3
occ:1.00
O D:HOH172 2.7 24.8 1.0
O D:HOH202 2.8 25.9 1.0
N D:HIS70 3.1 18.6 1.0
N D:LEU71 3.2 17.1 1.0
O D:ALA68 3.8 19.0 1.0
CB D:ALA65 3.8 16.8 1.0
CE1 D:HIS40 3.8 24.1 1.0
CA D:HIS70 3.9 18.6 1.0
C D:ALA69 3.9 19.9 1.0
CB D:LEU71 3.9 16.9 1.0
CA D:ALA69 3.9 19.4 1.0
C D:HIS70 3.9 18.3 1.0
CB D:ALA39 4.0 20.6 1.0
CB D:HIS70 4.1 19.5 1.0
CA D:LEU71 4.1 16.0 1.0
ND1 D:HIS40 4.1 27.3 1.0
O4 D:PO4167 4.2 56.1 1.0
O1 D:PO4168 4.3 49.6 1.0
O1 D:PO4167 4.6 58.5 1.0
NE2 D:HIS40 4.7 27.8 1.0
C D:ALA68 4.7 19.8 1.0
N D:ALA39 4.7 20.4 1.0
CG D:HIS70 4.8 20.2 1.0
N D:ALA69 4.8 19.5 1.0
CB D:ALA69 4.9 18.4 1.0
CA D:ALA39 5.0 19.7 1.0

Chlorine binding site 7 out of 14 in 3oow

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Chlorine binding site 7 out of 14 in the Octameric Structure of the Phosphoribosylaminoimidazole Carboxylase Catalytic Subunit From Francisella Tularensis Subsp. Tularensis Schu S4.


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 7 of Octameric Structure of the Phosphoribosylaminoimidazole Carboxylase Catalytic Subunit From Francisella Tularensis Subsp. Tularensis Schu S4. within 5.0Å range:
probe atom residue distance (Å) B Occ
D:Cl165

b:30.4
occ:1.00
O E:HOH302 2.8 36.2 1.0
N D:LYS45 3.3 22.1 1.0
CA D:THR42 3.5 18.8 1.0
C D:THR42 3.5 19.9 1.0
CB D:THR42 3.6 19.1 1.0
N D:ASP44 3.7 21.3 1.0
CB D:LYS45 3.7 23.8 1.0
O D:THR42 3.8 20.6 1.0
CB D:ASP44 3.8 23.4 1.0
CA D:ASP44 4.0 22.5 1.0
N D:PRO43 4.0 19.0 1.0
CA D:LYS45 4.1 22.3 1.0
C D:ASP44 4.1 21.6 1.0
CD2 E:LEU155 4.2 27.1 1.0
CG2 D:THR42 4.3 20.3 1.0
CG2 E:THR151 4.4 19.4 1.0
CD1 E:LEU155 4.4 26.8 1.0
CD D:PRO43 4.6 19.8 1.0
C D:PRO43 4.6 20.1 1.0
CG D:ASP44 4.6 27.2 1.0
CG E:LEU155 4.7 27.0 1.0
OD2 D:ASP44 4.7 34.9 1.0
OG1 D:THR42 4.7 20.0 1.0
O D:ARG41 4.8 19.7 1.0
N D:THR42 4.8 18.4 1.0
CA D:PRO43 5.0 19.5 1.0

Chlorine binding site 8 out of 14 in 3oow

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Chlorine binding site 8 out of 14 in the Octameric Structure of the Phosphoribosylaminoimidazole Carboxylase Catalytic Subunit From Francisella Tularensis Subsp. Tularensis Schu S4.


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 8 of Octameric Structure of the Phosphoribosylaminoimidazole Carboxylase Catalytic Subunit From Francisella Tularensis Subsp. Tularensis Schu S4. within 5.0Å range:
probe atom residue distance (Å) B Occ
E:Cl164

b:29.6
occ:1.00
O E:HOH196 2.8 31.6 1.0
O E:HOH383 2.9 29.2 1.0
N E:HIS70 3.0 20.1 1.0
N E:LEU71 3.2 18.2 1.0
CE1 E:HIS40 3.7 26.1 1.0
CB E:ALA65 3.8 21.8 1.0
O E:ALA68 3.8 23.5 1.0
CA E:HIS70 3.8 20.1 1.0
C E:ALA69 3.8 20.7 1.0
CA E:ALA69 3.9 20.4 1.0
CB E:LEU71 3.9 17.9 1.0
C E:HIS70 3.9 19.4 1.0
CB E:ALA39 4.0 21.3 1.0
ND1 E:HIS40 4.0 23.2 1.0
CB E:HIS70 4.0 21.8 1.0
CA E:LEU71 4.1 18.1 1.0
O1 E:PO4167 4.2 49.5 1.0
O4 E:PO4166 4.3 46.1 1.0
NE2 E:HIS40 4.4 24.2 1.0
O2 E:PO4167 4.4 48.1 1.0
C E:ALA68 4.7 22.4 1.0
CG E:HIS70 4.7 19.6 1.0
N E:ALA69 4.8 20.2 1.0
N E:ALA39 4.9 21.8 1.0
CB E:ALA69 4.9 18.8 1.0
P E:PO4167 4.9 50.8 1.0
CG E:HIS40 4.9 22.0 1.0
O E:ALA69 5.0 22.6 1.0

Chlorine binding site 9 out of 14 in 3oow

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Chlorine binding site 9 out of 14 in the Octameric Structure of the Phosphoribosylaminoimidazole Carboxylase Catalytic Subunit From Francisella Tularensis Subsp. Tularensis Schu S4.


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 9 of Octameric Structure of the Phosphoribosylaminoimidazole Carboxylase Catalytic Subunit From Francisella Tularensis Subsp. Tularensis Schu S4. within 5.0Å range:
probe atom residue distance (Å) B Occ
E:Cl165

b:40.1
occ:1.00
O E:HOH257 2.6 32.1 1.0
O E:HOH478 2.9 29.8 1.0
N E:LYS45 3.1 22.9 1.0
CA E:THR42 3.4 21.7 1.0
C E:THR42 3.5 20.3 1.0
N E:ASP44 3.5 23.5 1.0
CB E:THR42 3.6 22.3 1.0
CB E:ASP44 3.6 25.5 1.0
O E:THR42 3.7 19.9 1.0
CA E:ASP44 3.8 24.2 1.0
CB E:LYS45 3.9 23.4 1.0
C E:ASP44 3.9 23.9 1.0
N E:PRO43 4.0 21.1 1.0
CA E:LYS45 4.1 23.1 1.0
CG2 E:THR42 4.3 23.1 1.0
CG2 G:THR151 4.3 23.8 1.0
CD2 G:LEU155 4.3 26.2 1.0
C E:PRO43 4.4 22.7 1.0
CG E:ASP44 4.5 29.6 1.0
CD E:PRO43 4.5 21.5 1.0
OD2 E:ASP44 4.7 36.4 1.0
OG1 E:THR42 4.7 22.3 1.0
N E:THR42 4.8 21.2 1.0
CA E:PRO43 4.8 21.7 1.0
O E:ARG41 4.8 23.5 1.0
CD1 G:LEU155 4.8 27.8 1.0
O G:HOH513 4.9 45.1 1.0
CG G:LEU155 5.0 26.7 1.0

Chlorine binding site 10 out of 14 in 3oow

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Chlorine binding site 10 out of 14 in the Octameric Structure of the Phosphoribosylaminoimidazole Carboxylase Catalytic Subunit From Francisella Tularensis Subsp. Tularensis Schu S4.


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 10 of Octameric Structure of the Phosphoribosylaminoimidazole Carboxylase Catalytic Subunit From Francisella Tularensis Subsp. Tularensis Schu S4. within 5.0Å range:
probe atom residue distance (Å) B Occ
F:Cl164

b:29.5
occ:1.00
O F:HOH174 2.7 25.9 1.0
O F:HOH221 3.1 29.8 1.0
N F:HIS70 3.1 19.8 1.0
N F:LEU71 3.2 18.4 1.0
CE1 F:HIS40 3.7 24.5 1.0
CB F:ALA65 3.7 17.6 1.0
O F:ALA68 3.9 22.2 1.0
CB F:LEU71 3.9 17.0 1.0
CA F:HIS70 3.9 19.1 1.0
CA F:ALA69 3.9 20.2 1.0
C F:ALA69 4.0 20.4 1.0
ND1 F:HIS40 4.0 24.7 1.0
C F:HIS70 4.0 18.7 1.0
CB F:ALA39 4.1 21.4 1.0
CA F:LEU71 4.1 17.7 1.0
CB F:HIS70 4.1 19.1 1.0
O3 F:PO4167 4.3 49.2 1.0
O1 F:PO4167 4.4 46.7 1.0
NE2 F:HIS40 4.4 27.6 1.0
O3 F:PO4168 4.5 47.4 1.0
CG F:HIS70 4.8 19.6 1.0
C F:ALA68 4.8 21.4 1.0
N F:ALA69 4.8 19.4 1.0
N F:ALA39 4.9 21.8 1.0
CG F:HIS40 4.9 21.9 1.0
CB F:ALA69 5.0 19.7 1.0
P F:PO4167 5.0 49.8 1.0

Reference:

E.V.Filippova, Z.Wawrzak, M.Kudritska, A.Edwards, A.Savchenko, F.W.Anderson. Octameric Structure of the Phosphoribosylaminoimidazole Carboxylase Catalytic Subunit From Francisella Tularensis Subsp. Tularensis Schu S4. To Be Published.
Page generated: Sun Jul 21 01:50:53 2024

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