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:
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
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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 Sites List in 5i1f
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
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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
|