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Chlorine in PDB 5i1f: Crystal Structure of Utp-Glucose-1-Phosphate Uridylyltransferase From Burkholderia Vietnamiensis in Complex with Uridine-5'-Diphosphate- Glucose

Enzymatic activity of Crystal Structure of Utp-Glucose-1-Phosphate Uridylyltransferase From Burkholderia Vietnamiensis in Complex with Uridine-5'-Diphosphate- Glucose

All present enzymatic activity of Crystal Structure of Utp-Glucose-1-Phosphate Uridylyltransferase From Burkholderia Vietnamiensis in Complex with Uridine-5'-Diphosphate- Glucose:
2.7.7.9;

Protein crystallography data

The structure of Crystal Structure of Utp-Glucose-1-Phosphate Uridylyltransferase From Burkholderia Vietnamiensis in Complex with Uridine-5'-Diphosphate- Glucose, PDB code: 5i1f was solved by Seattle Structural Genomics Center For Infectious Disease (Ssgcid), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 50.00 / 2.15
Space group P 62 2 2
Cell size a, b, c (Å), α, β, γ (°) 84.900, 84.900, 252.700, 90.00, 90.00, 120.00
R / Rfree (%) 17.2 / 20.3

Other elements in 5i1f:

The structure of Crystal Structure of Utp-Glucose-1-Phosphate Uridylyltransferase From Burkholderia Vietnamiensis in Complex with Uridine-5'-Diphosphate- Glucose also contains other interesting chemical elements:

Magnesium (Mg) 2 atoms

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Crystal Structure of Utp-Glucose-1-Phosphate Uridylyltransferase From Burkholderia Vietnamiensis in Complex with Uridine-5'-Diphosphate- Glucose (pdb code 5i1f). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 6 binding sites of Chlorine where determined in the Crystal Structure of Utp-Glucose-1-Phosphate Uridylyltransferase From Burkholderia Vietnamiensis in Complex with Uridine-5'-Diphosphate- Glucose, PDB code: 5i1f:
Jump to Chlorine binding site number: 1; 2; 3; 4; 5; 6;

Chlorine binding site 1 out of 6 in 5i1f

Go back to Chlorine Binding Sites List in 5i1f
Chlorine binding site 1 out of 6 in the Crystal Structure of Utp-Glucose-1-Phosphate Uridylyltransferase From Burkholderia Vietnamiensis in Complex with Uridine-5'-Diphosphate- Glucose


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Crystal Structure of Utp-Glucose-1-Phosphate Uridylyltransferase From Burkholderia Vietnamiensis in Complex with Uridine-5'-Diphosphate- Glucose within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl304

b:50.1
occ:0.71
N A:ALA166 3.4 61.6 1.0
CB A:ALA166 3.5 68.3 1.0
CD A:PRO165 3.6 53.6 1.0
CB A:ALA164 3.6 53.6 1.0
N A:PRO165 3.8 51.9 1.0
CA A:ALA166 4.0 64.8 1.0
C A:ALA164 4.2 50.1 1.0
C A:PRO165 4.3 58.6 1.0
CA A:ALA164 4.4 51.3 1.0
CA A:PRO165 4.4 53.9 1.0
CG A:PRO165 4.5 53.6 1.0
CB A:PRO165 4.5 56.1 1.0
O A:ALA164 4.8 48.2 1.0

Chlorine binding site 2 out of 6 in 5i1f

Go back to Chlorine Binding Sites List in 5i1f
Chlorine binding site 2 out of 6 in the Crystal Structure of Utp-Glucose-1-Phosphate Uridylyltransferase From Burkholderia Vietnamiensis in Complex with Uridine-5'-Diphosphate- Glucose


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Crystal Structure of Utp-Glucose-1-Phosphate Uridylyltransferase From Burkholderia Vietnamiensis in Complex with Uridine-5'-Diphosphate- Glucose within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl305

b:54.3
occ:0.82
O A:HOH575 2.9 47.9 1.0
CD A:PRO126 3.7 39.6 1.0
CG A:LYS211 3.8 45.6 1.0
CG A:PRO126 3.8 45.1 1.0
CZ A:PHE150 3.9 44.7 1.0
CB A:PRO126 3.9 32.2 1.0
CD A:PRO212 4.1 33.1 1.0
CD1 A:LEU2 4.1 78.7 1.0
CE A:LYS211 4.3 52.1 1.0
N A:PRO126 4.3 42.7 1.0
CE1 A:PHE150 4.4 44.9 1.0
CB A:LYS211 4.5 36.0 1.0
CD A:LYS211 4.6 51.0 1.0
CA A:PRO126 4.6 39.0 1.0
CB A:LEU2 4.7 78.0 1.0
CA A:LYS211 4.8 33.1 1.0
CE2 A:PHE150 4.9 40.1 1.0
CG A:PRO212 5.0 35.0 1.0
CG A:LEU2 5.0 81.4 1.0

Chlorine binding site 3 out of 6 in 5i1f

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Chlorine binding site 3 out of 6 in the Crystal Structure of Utp-Glucose-1-Phosphate Uridylyltransferase From Burkholderia Vietnamiensis in Complex with Uridine-5'-Diphosphate- Glucose


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of Crystal Structure of Utp-Glucose-1-Phosphate Uridylyltransferase From Burkholderia Vietnamiensis in Complex with Uridine-5'-Diphosphate- Glucose within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl306

b:41.9
occ:0.60
O A:HOH575 2.7 47.9 1.0
O A:HOH401 2.8 54.8 1.0
O A:HOH561 3.0 59.9 1.0
N A:LYS213 3.3 39.3 1.0
CB A:LYS213 3.4 38.4 1.0
CD A:PRO212 3.5 33.1 1.0
CG A:PRO212 3.6 35.0 1.0
CB A:LYS211 3.7 36.0 1.0
N A:PRO212 3.8 31.6 1.0
CA A:LYS213 3.9 42.4 1.0
CE A:LYS211 4.2 52.1 1.0
C A:LYS211 4.2 33.0 1.0
C A:PRO212 4.2 39.1 1.0
CA A:PRO212 4.5 37.6 1.0
CG A:LYS211 4.5 45.6 1.0
CA A:LYS211 4.5 33.1 1.0
CG A:LYS213 4.6 49.5 1.0
CB A:PRO212 4.6 36.6 1.0
OE2 A:GLU242 4.7 56.5 1.0
OE1 A:GLU242 4.8 57.7 1.0
CD A:LYS211 4.8 51.0 1.0
O A:LYS211 4.8 31.0 1.0
CE A:LYS213 4.9 68.4 1.0

Chlorine binding site 4 out of 6 in 5i1f

Go back to Chlorine Binding Sites List in 5i1f
Chlorine binding site 4 out of 6 in the Crystal Structure of Utp-Glucose-1-Phosphate Uridylyltransferase From Burkholderia Vietnamiensis in Complex with Uridine-5'-Diphosphate- Glucose


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 4 of Crystal Structure of Utp-Glucose-1-Phosphate Uridylyltransferase From Burkholderia Vietnamiensis in Complex with Uridine-5'-Diphosphate- Glucose within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl307

b:38.5
occ:0.62
O A:HOH547 3.0 47.7 1.0
N A:ASP255 3.1 38.9 1.0
CA A:PHE254 3.7 41.1 1.0
CA A:GLY261 3.8 38.9 1.0
C A:PHE254 3.9 44.2 1.0
O A:ARG253 4.1 45.7 1.0
CD A:LYS264 4.1 51.3 1.0
CA A:ASP255 4.1 44.7 1.0
CB A:ASP255 4.2 50.3 1.0
CD1 A:PHE254 4.3 42.2 1.0
CB A:PHE254 4.4 40.6 1.0
NZ A:LYS264 4.5 58.3 1.0
N A:PHE254 4.7 44.4 1.0
C A:ASP255 4.7 41.5 1.0
O A:ASP255 4.7 37.8 1.0
N A:GLY261 4.7 39.0 1.0
C A:ARG253 4.8 45.3 1.0
C A:GLY261 4.8 39.3 1.0
O A:HOH526 4.8 47.6 1.0
CG A:PHE254 4.8 45.2 1.0
O A:GLY261 4.9 41.3 1.0
CE A:LYS264 4.9 50.5 1.0

Chlorine binding site 5 out of 6 in 5i1f

Go back to Chlorine Binding Sites List in 5i1f
Chlorine binding site 5 out of 6 in the Crystal Structure of Utp-Glucose-1-Phosphate Uridylyltransferase From Burkholderia Vietnamiensis in Complex with Uridine-5'-Diphosphate- Glucose


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 5 of Crystal Structure of Utp-Glucose-1-Phosphate Uridylyltransferase From Burkholderia Vietnamiensis in Complex with Uridine-5'-Diphosphate- Glucose within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl308

b:34.8
occ:0.85
O A:HOH488 3.0 40.2 1.0
NZ A:LYS27 3.3 26.3 1.0
O A:HOH469 3.4 38.6 1.0
CA A:GLY13 3.4 36.4 1.0
N A:GLY15 3.5 31.8 1.0
CE A:LYS27 3.6 33.3 1.0
C A:GLY13 3.7 34.9 1.0
N A:LEU14 3.8 36.7 1.0
CD A:LYS27 3.9 34.6 1.0
O A:HOH554 3.9 38.5 1.0
CA A:GLY15 4.0 30.9 1.0
C2C A:UPG301 4.0 28.9 1.0
O2C A:UPG301 4.1 29.8 1.0
O2A A:UPG301 4.2 27.2 1.0
N A:GLY13 4.3 32.6 1.0
CG A:LYS27 4.4 32.6 1.0
O A:HOH536 4.4 28.2 1.0
O A:GLY13 4.4 38.7 1.0
O A:HOH461 4.4 34.7 1.0
O A:HOH507 4.4 37.6 1.0
C A:LEU14 4.5 37.9 1.0
O A:HOH510 4.5 48.8 1.0
O5C A:UPG301 4.6 30.9 1.0
C6 A:UPG301 4.7 27.8 1.0
MG A:MG302 4.7 45.2 1.0
PA A:UPG301 4.7 29.3 1.0
O1A A:UPG301 4.7 22.1 1.0
CA A:LEU14 4.7 38.8 1.0
OE2 A:GLU28 4.8 30.9 1.0
O A:HOH424 4.8 36.7 1.0
C3C A:UPG301 4.9 31.7 1.0

Chlorine binding site 6 out of 6 in 5i1f

Go back to Chlorine Binding Sites List in 5i1f
Chlorine binding site 6 out of 6 in the Crystal Structure of Utp-Glucose-1-Phosphate Uridylyltransferase From Burkholderia Vietnamiensis in Complex with Uridine-5'-Diphosphate- Glucose


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 6 of Crystal Structure of Utp-Glucose-1-Phosphate Uridylyltransferase From Burkholderia Vietnamiensis in Complex with Uridine-5'-Diphosphate- Glucose within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl309

b:45.9
occ:0.86
N A:LYS259 3.2 42.3 1.0
O A:HOH492 3.2 49.9 1.0
CD A:LYS259 3.4 61.1 1.0
CD A:ARG17 3.7 42.9 1.0
CA A:SER258 3.7 42.0 1.0
CB A:SER258 3.9 44.3 1.0
C A:SER258 3.9 41.0 1.0
CB A:LYS259 4.0 44.6 1.0
CG A:ARG17 4.0 39.1 1.0
CB A:ARG17 4.1 39.6 1.0
NE A:ARG17 4.2 47.4 1.0
CA A:LYS259 4.2 42.2 1.0
NZ A:LYS259 4.2 72.1 1.0
CE A:LYS259 4.2 60.4 1.0
CG A:LYS259 4.2 48.1 1.0
CZ A:ARG17 4.7 52.6 1.0
NH1 A:ARG17 4.9 42.2 1.0
N A:LEU260 4.9 41.9 1.0
O A:GLY257 4.9 36.9 1.0

Reference:

J.Abendroth, D.D.Lorimer, T.E.Edwards. Crystal Structure of Utp-Glucose-1-Phosphate Uridylyltransferase From Burkholderia Vietnamiensis in Complex with Uridine-5'-Diphosphate-Glucose To Be Published.
Page generated: Fri Jul 26 09:08:39 2024

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