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Chlorine in PDB 5c80: X-Ray Structure Uridine Phosphorylase From Vibrio Cholerae in Complex with Uridine at 2.24 A Resolution

Enzymatic activity of X-Ray Structure Uridine Phosphorylase From Vibrio Cholerae in Complex with Uridine at 2.24 A Resolution

All present enzymatic activity of X-Ray Structure Uridine Phosphorylase From Vibrio Cholerae in Complex with Uridine at 2.24 A Resolution:
2.4.2.3;

Protein crystallography data

The structure of X-Ray Structure Uridine Phosphorylase From Vibrio Cholerae in Complex with Uridine at 2.24 A Resolution, PDB code: 5c80 was solved by I.I.Prokofev, A.A.Lashkov, A.G.Gabdoulkhakov, C.Betzel, A.M.Mikhailov, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 45.47 / 2.24
Space group P 1
Cell size a, b, c (Å), α, β, γ (°) 61.255, 73.110, 83.137, 71.81, 77.19, 85.69
R / Rfree (%) 16.8 / 23.7

Other elements in 5c80:

The structure of X-Ray Structure Uridine Phosphorylase From Vibrio Cholerae in Complex with Uridine at 2.24 A Resolution also contains other interesting chemical elements:

Sodium (Na) 2 atoms

Chlorine Binding Sites:

The binding sites of Chlorine atom in the X-Ray Structure Uridine Phosphorylase From Vibrio Cholerae in Complex with Uridine at 2.24 A Resolution (pdb code 5c80). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 6 binding sites of Chlorine where determined in the X-Ray Structure Uridine Phosphorylase From Vibrio Cholerae in Complex with Uridine at 2.24 A Resolution, PDB code: 5c80:
Jump to Chlorine binding site number: 1; 2; 3; 4; 5; 6;

Chlorine binding site 1 out of 6 in 5c80

Go back to Chlorine Binding Sites List in 5c80
Chlorine binding site 1 out of 6 in the X-Ray Structure Uridine Phosphorylase From Vibrio Cholerae in Complex with Uridine at 2.24 A Resolution


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of X-Ray Structure Uridine Phosphorylase From Vibrio Cholerae in Complex with Uridine at 2.24 A Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl304

b:41.8
occ:1.00
NH1 A:ARG29 3.0 64.2 1.0
O A:HOH467 3.1 29.6 1.0
N A:GLY25 3.2 25.3 1.0
N A:ASP26 3.4 28.4 1.0
CA A:GLY25 3.5 25.3 1.0
NH2 B:ARG47 3.6 27.0 1.0
CA A:GLY92 3.9 25.2 1.0
C A:GLY25 3.9 25.9 1.0
NH1 B:ARG47 4.0 27.1 1.0
CB A:ASP26 4.0 29.4 1.0
O A:VAL91 4.2 27.6 1.0
NH2 A:ARG90 4.2 24.2 0.5
CZ A:ARG29 4.2 59.6 1.0
N A:THR93 4.2 26.9 1.0
CZ B:ARG47 4.3 26.4 1.0
CA A:ASP26 4.4 29.1 1.0
C A:GLY92 4.4 25.0 1.0
CG2 A:THR93 4.4 30.0 1.0
C A:PRO24 4.4 26.0 1.0
CD A:ARG29 4.6 49.5 1.0
OG1 A:THR93 4.8 28.9 1.0
CB A:PRO24 4.8 26.2 1.0
NE A:ARG29 4.8 56.9 1.0
CA A:PRO24 4.9 25.9 1.0
N A:GLY92 4.9 26.0 1.0
C A:VAL91 5.0 25.6 1.0
NH2 A:ARG90 5.0 20.9 0.5

Chlorine binding site 2 out of 6 in 5c80

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Chlorine binding site 2 out of 6 in the X-Ray Structure Uridine Phosphorylase From Vibrio Cholerae in Complex with Uridine at 2.24 A Resolution


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of X-Ray Structure Uridine Phosphorylase From Vibrio Cholerae in Complex with Uridine at 2.24 A Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl305

b:53.9
occ:1.00
N A:TYR168 3.3 22.7 1.0
CA A:ARG167 3.9 22.2 1.0
O A:HOH471 3.9 55.1 1.0
C A:ARG167 4.1 22.7 1.0
N A:ASP169 4.1 27.2 1.0
CA A:TYR168 4.2 23.4 1.0
O A:GLU166 4.2 23.4 1.0
CB A:TYR168 4.2 23.1 1.0
NH2 A:ARG222 4.2 26.4 1.0
CD2 A:TYR168 4.4 22.1 1.0
CB A:ARG167 4.6 22.8 1.0
C A:TYR168 4.6 25.4 1.0
CG A:TYR168 4.8 22.8 1.0
CG A:ARG167 4.8 22.2 1.0
N A:ARG167 4.9 23.4 1.0
CB A:ASP169 5.0 35.9 1.0
C A:GLU166 5.0 21.8 1.0

Chlorine binding site 3 out of 6 in 5c80

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Chlorine binding site 3 out of 6 in the X-Ray Structure Uridine Phosphorylase From Vibrio Cholerae in Complex with Uridine at 2.24 A Resolution


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of X-Ray Structure Uridine Phosphorylase From Vibrio Cholerae in Complex with Uridine at 2.24 A Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl305

b:45.7
occ:1.00
O B:HOH480 3.2 39.4 1.0
N B:GLY25 3.3 24.0 1.0
NH2 A:ARG47 3.5 36.6 1.0
N B:ASP26 3.6 29.8 1.0
CA B:GLY25 3.6 26.0 1.0
NH1 B:ARG29 3.8 43.6 1.0
CA B:GLY92 3.9 20.6 1.0
NH1 A:ARG47 4.0 34.0 1.0
CB B:ASP26 4.0 31.4 1.0
C B:GLY25 4.1 28.1 1.0
O B:VAL91 4.1 22.0 1.0
CZ B:ARG29 4.1 47.1 1.0
CD B:ARG29 4.2 39.3 1.0
CZ A:ARG47 4.2 33.4 1.0
NE B:ARG29 4.3 44.6 1.0
C B:PRO24 4.4 23.4 1.0
N B:THR93 4.4 23.4 1.0
CA B:ASP26 4.5 31.6 1.0
C B:GLY92 4.6 21.6 1.0
CA B:PRO24 4.8 24.2 1.0
CB B:PRO24 4.8 23.9 1.0
NH2 B:ARG90 4.8 33.3 1.0
N B:GLY92 4.8 20.2 1.0
C B:VAL91 4.9 20.7 1.0
NH2 B:ARG29 4.9 46.7 1.0
OG1 B:THR93 4.9 27.7 1.0

Chlorine binding site 4 out of 6 in 5c80

Go back to Chlorine Binding Sites List in 5c80
Chlorine binding site 4 out of 6 in the X-Ray Structure Uridine Phosphorylase From Vibrio Cholerae in Complex with Uridine at 2.24 A Resolution


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 4 of X-Ray Structure Uridine Phosphorylase From Vibrio Cholerae in Complex with Uridine at 2.24 A Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Cl304

b:56.8
occ:1.00
N C:GLY25 3.1 25.2 1.0
O C:HOH420 3.2 37.6 1.0
NH2 C:ARG29 3.4 61.0 1.0
N C:ASP26 3.7 32.4 1.0
CZ C:ARG29 3.7 55.9 1.0
O C:VAL91 3.7 26.2 1.0
CA C:GLY25 3.7 28.1 1.0
NE C:ARG29 4.0 50.2 1.0
CD C:ARG29 4.0 47.3 1.0
C C:PRO24 4.1 25.8 1.0
CB C:PRO24 4.1 23.6 1.0
CA C:GLY92 4.1 25.6 1.0
O C:HOH430 4.1 31.0 1.0
CA C:PRO24 4.2 24.0 1.0
C C:GLY25 4.3 30.5 1.0
NH1 C:ARG29 4.4 51.5 1.0
CB C:ASP26 4.4 33.9 1.0
C C:VAL91 4.6 26.9 1.0
NH2 C:ARG90 4.7 28.7 1.0
CA C:ASP26 4.7 34.5 1.0
N C:THR93 4.7 26.5 1.0
NH1 D:ARG47 4.7 30.2 1.0
C C:GLY92 4.8 26.4 1.0
N C:GLY92 4.9 25.6 1.0

Chlorine binding site 5 out of 6 in 5c80

Go back to Chlorine Binding Sites List in 5c80
Chlorine binding site 5 out of 6 in the X-Ray Structure Uridine Phosphorylase From Vibrio Cholerae in Complex with Uridine at 2.24 A Resolution


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 5 of X-Ray Structure Uridine Phosphorylase From Vibrio Cholerae in Complex with Uridine at 2.24 A Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
D:Cl305

b:55.3
occ:1.00
N D:GLY25 3.0 21.9 1.0
O D:HOH435 3.2 48.5 1.0
N D:ASP26 3.2 28.7 1.0
CA D:GLY25 3.4 25.2 1.0
NH2 C:ARG47 3.7 40.7 1.0
C D:GLY25 3.8 27.3 1.0
NE D:ARG29 4.0 51.5 1.0
C D:PRO24 4.1 21.2 1.0
O D:VAL91 4.1 23.9 1.0
CZ D:ARG29 4.1 55.0 1.0
CB D:ASP26 4.1 28.6 1.0
CD D:ARG29 4.2 45.7 1.0
NH1 D:ARG29 4.3 51.7 1.0
CA D:ASP26 4.3 29.4 1.0
CA D:GLY92 4.3 28.3 1.0
CB D:PRO24 4.4 20.4 1.0
CA D:PRO24 4.4 21.6 1.0
NH1 C:ARG47 4.4 37.5 1.0
CZ C:ARG47 4.5 36.4 1.0
NH2 D:ARG29 4.6 52.0 1.0
NH2 D:ARG90 4.7 34.7 1.0
C D:VAL91 5.0 25.4 1.0
N D:THR93 5.0 30.4 1.0

Chlorine binding site 6 out of 6 in 5c80

Go back to Chlorine Binding Sites List in 5c80
Chlorine binding site 6 out of 6 in the X-Ray Structure Uridine Phosphorylase From Vibrio Cholerae in Complex with Uridine at 2.24 A Resolution


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 6 of X-Ray Structure Uridine Phosphorylase From Vibrio Cholerae in Complex with Uridine at 2.24 A Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
F:Cl306

b:44.5
occ:1.00
N F:GLY25 3.2 21.9 1.0
O F:HOH488 3.4 31.1 1.0
N F:ASP26 3.4 28.4 1.0
NE F:ARG29 3.6 42.9 1.0
CA F:GLY25 3.7 24.5 1.0
CB F:ASP26 3.9 29.2 1.0
O F:VAL91 3.9 24.4 1.0
CZ F:ARG29 4.0 45.0 1.0
NH2 E:ARG47 4.0 42.1 1.0
C F:GLY25 4.0 26.0 1.0
CD F:ARG29 4.0 37.9 1.0
CA F:GLY92 4.0 23.1 1.0
NH2 F:ARG29 4.2 44.4 1.0
C F:PRO24 4.2 22.4 1.0
CA F:ASP26 4.3 28.9 1.0
NH1 E:ARG47 4.5 39.4 1.0
CB F:PRO24 4.5 21.4 1.0
CA F:PRO24 4.5 21.1 1.0
N F:THR93 4.6 24.4 1.0
NH2 F:ARG90 4.6 15.6 0.5
CZ E:ARG47 4.7 39.1 1.0
NH1 F:ARG29 4.7 43.2 1.0
C F:GLY92 4.7 23.9 1.0
CG2 F:THR93 4.8 26.5 1.0
C F:VAL91 4.8 22.8 1.0
N F:GLY92 5.0 22.0 1.0
NH2 F:ARG90 5.0 17.8 0.5

Reference:

I.I.Prokofev, A.A.Lashkov, A.G.Gabdoulkhakov, V.V.Balaev, T.A.Seregina, A.S.Mironov, C.Betzel, A.M.Mikhailov. X-Ray Structures of Uridine Phosphorylase From Vibrio Cholerae in Complexes with Uridine, Thymidine, Uracil, Thymine, and Phosphate Anion: Substrate Specificity of Bacterial Uridine Phosphorylases Crystallography Reports V. 61 954 2016.
ISSN: ISSN 1063-7745
DOI: 10.1134/S1063774516060134
Page generated: Sat Dec 12 11:34:34 2020

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