Magnesium in PDB 6sz0: The Glucuronoyl Esterase OTCE15A H408A Variant From Opitutus Terrae
Protein crystallography data
The structure of The Glucuronoyl Esterase OTCE15A H408A Variant From Opitutus Terrae, PDB code: 6sz0
was solved by
S.Mazurkewich,
J.C.Navarro Poulsen,
J.Larsbrink,
L.Lo Leggio,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
45.39 /
1.74
|
Space group
|
P 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
43.197,
44.204,
50.154,
76.31,
65.70,
70.74
|
R / Rfree (%)
|
14.2 /
19.2
|
Magnesium Binding Sites:
The binding sites of Magnesium atom in the The Glucuronoyl Esterase OTCE15A H408A Variant From Opitutus Terrae
(pdb code 6sz0). This binding sites where shown within
5.0 Angstroms radius around Magnesium atom.
In total 2 binding sites of Magnesium where determined in the
The Glucuronoyl Esterase OTCE15A H408A Variant From Opitutus Terrae, PDB code: 6sz0:
Jump to Magnesium binding site number:
1;
2;
Magnesium binding site 1 out
of 2 in 6sz0
Go back to
Magnesium Binding Sites List in 6sz0
Magnesium binding site 1 out
of 2 in the The Glucuronoyl Esterase OTCE15A H408A Variant From Opitutus Terrae
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 1 of The Glucuronoyl Esterase OTCE15A H408A Variant From Opitutus Terrae within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg501
b:25.3
occ:1.00
|
O
|
A:HOH760
|
2.3
|
22.7
|
1.0
|
O
|
A:HIS303
|
2.3
|
29.0
|
1.0
|
O
|
A:GLU305
|
2.3
|
27.1
|
1.0
|
O
|
A:HOH654
|
2.4
|
28.8
|
1.0
|
O
|
A:HOH785
|
2.4
|
28.1
|
1.0
|
O
|
A:HOH669
|
2.5
|
40.0
|
1.0
|
H
|
A:HIS303
|
3.2
|
33.1
|
1.0
|
HB2
|
A:ASP360
|
3.4
|
27.3
|
1.0
|
C
|
A:GLU305
|
3.5
|
26.5
|
1.0
|
C
|
A:HIS303
|
3.5
|
28.4
|
1.0
|
HB2
|
A:CYS293
|
3.6
|
29.6
|
1.0
|
HB3
|
A:ASP360
|
3.8
|
27.3
|
1.0
|
HA
|
A:THR306
|
3.9
|
27.1
|
1.0
|
N
|
A:HIS303
|
4.0
|
27.6
|
1.0
|
N
|
A:GLU305
|
4.0
|
20.7
|
1.0
|
H
|
A:GLU305
|
4.0
|
24.8
|
1.0
|
HB2
|
A:ALA297
|
4.0
|
27.5
|
1.0
|
CB
|
A:ASP360
|
4.0
|
22.7
|
1.0
|
HB3
|
A:GLU305
|
4.1
|
28.7
|
1.0
|
C
|
A:GLY304
|
4.2
|
27.7
|
1.0
|
CA
|
A:GLU305
|
4.2
|
21.6
|
1.0
|
HA3
|
A:GLY304
|
4.3
|
28.9
|
1.0
|
HB3
|
A:HIS303
|
4.3
|
33.6
|
1.0
|
CA
|
A:HIS303
|
4.3
|
24.3
|
1.0
|
HA
|
A:CYS293
|
4.3
|
25.0
|
1.0
|
O
|
A:LEU298
|
4.4
|
29.9
|
1.0
|
CB
|
A:CYS293
|
4.4
|
24.7
|
1.0
|
O
|
A:TRP358
|
4.5
|
24.9
|
1.0
|
N
|
A:GLY304
|
4.5
|
22.7
|
1.0
|
OD2
|
A:ASP360
|
4.5
|
23.6
|
1.0
|
N
|
A:THR306
|
4.5
|
23.2
|
1.0
|
HB3
|
A:ALA297
|
4.5
|
27.5
|
1.0
|
CA
|
A:GLY304
|
4.5
|
24.1
|
1.0
|
HG21
|
A:THR306
|
4.6
|
32.4
|
1.0
|
HA
|
A:SER299
|
4.6
|
27.6
|
1.0
|
O
|
A:HOH633
|
4.6
|
28.4
|
1.0
|
CB
|
A:GLU305
|
4.7
|
23.9
|
1.0
|
CA
|
A:THR306
|
4.7
|
22.6
|
1.0
|
CB
|
A:ALA297
|
4.7
|
23.0
|
1.0
|
O
|
A:GLY304
|
4.7
|
24.8
|
1.0
|
SG
|
A:CYS293
|
4.7
|
27.5
|
1.0
|
CG
|
A:ASP360
|
4.7
|
28.5
|
1.0
|
CA
|
A:CYS293
|
4.8
|
20.9
|
1.0
|
H
|
A:ILE302
|
4.8
|
43.5
|
1.0
|
CB
|
A:HIS303
|
4.9
|
28.0
|
1.0
|
HA
|
A:ILE302
|
4.9
|
33.7
|
1.0
|
HG
|
A:CYS293
|
4.9
|
33.0
|
1.0
|
|
Magnesium binding site 2 out
of 2 in 6sz0
Go back to
Magnesium Binding Sites List in 6sz0
Magnesium binding site 2 out
of 2 in the The Glucuronoyl Esterase OTCE15A H408A Variant From Opitutus Terrae
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 2 of The Glucuronoyl Esterase OTCE15A H408A Variant From Opitutus Terrae within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg502
b:35.7
occ:1.00
|
O
|
A:HOH746
|
2.2
|
29.5
|
1.0
|
O
|
A:LEU250
|
2.5
|
25.7
|
1.0
|
O
|
A:ASP253
|
2.7
|
26.9
|
1.0
|
O
|
A:VAL256
|
2.7
|
29.6
|
1.0
|
O
|
A:HOH790
|
3.2
|
50.4
|
1.0
|
HA
|
A:GLU251
|
3.2
|
30.6
|
1.0
|
H
|
A:ALA258
|
3.3
|
31.4
|
1.0
|
HG23
|
A:VAL256
|
3.4
|
38.5
|
1.0
|
O
|
A:GLU251
|
3.4
|
31.1
|
1.0
|
H
|
A:ASP253
|
3.5
|
27.4
|
1.0
|
C
|
A:GLU251
|
3.5
|
30.4
|
1.0
|
C
|
A:LEU250
|
3.6
|
23.6
|
1.0
|
HG21
|
A:VAL256
|
3.6
|
38.5
|
1.0
|
HB1
|
A:ALA258
|
3.7
|
29.0
|
1.0
|
C
|
A:ASP253
|
3.7
|
23.8
|
1.0
|
CA
|
A:GLU251
|
3.7
|
25.5
|
1.0
|
C
|
A:VAL256
|
3.8
|
26.6
|
1.0
|
HH11
|
A:ARG132
|
3.8
|
0.0
|
1.0
|
N
|
A:ASP253
|
3.8
|
22.8
|
1.0
|
H
|
A:VAL256
|
3.9
|
31.2
|
1.0
|
HH12
|
A:ARG132
|
3.9
|
0.0
|
1.0
|
NH1
|
A:ARG132
|
4.0
|
84.2
|
1.0
|
CG2
|
A:VAL256
|
4.0
|
32.1
|
1.0
|
HA
|
A:ASP257
|
4.0
|
26.7
|
1.0
|
N
|
A:ALA258
|
4.0
|
26.2
|
1.0
|
HB3
|
A:ALA258
|
4.0
|
29.0
|
1.0
|
HB3
|
A:ASP253
|
4.1
|
31.8
|
1.0
|
N
|
A:GLU251
|
4.2
|
24.1
|
1.0
|
N
|
A:THR252
|
4.2
|
27.5
|
1.0
|
HA
|
A:PRO254
|
4.2
|
35.0
|
1.0
|
CB
|
A:ALA258
|
4.3
|
24.1
|
1.0
|
CA
|
A:ASP253
|
4.3
|
26.6
|
1.0
|
HD3
|
A:ARG132
|
4.3
|
50.0
|
1.0
|
C
|
A:THR252
|
4.5
|
26.3
|
1.0
|
N
|
A:ASP257
|
4.6
|
24.4
|
1.0
|
N
|
A:VAL256
|
4.6
|
26.0
|
1.0
|
CA
|
A:ASP257
|
4.6
|
22.3
|
1.0
|
H
|
A:THR252
|
4.6
|
33.0
|
1.0
|
HG22
|
A:VAL256
|
4.6
|
38.5
|
1.0
|
CA
|
A:VAL256
|
4.6
|
28.6
|
1.0
|
N
|
A:PRO254
|
4.7
|
24.3
|
1.0
|
CZ
|
A:ARG132
|
4.7
|
78.9
|
1.0
|
CB
|
A:ASP253
|
4.7
|
26.5
|
1.0
|
CA
|
A:ALA258
|
4.8
|
28.8
|
1.0
|
C
|
A:ASP257
|
4.8
|
22.6
|
1.0
|
O
|
A:HOH678
|
4.8
|
50.8
|
1.0
|
CA
|
A:PRO254
|
4.8
|
29.2
|
1.0
|
CA
|
A:THR252
|
4.8
|
27.0
|
1.0
|
HA
|
A:LEU250
|
4.9
|
29.3
|
1.0
|
CA
|
A:LEU250
|
4.9
|
24.4
|
1.0
|
HB3
|
A:LEU250
|
4.9
|
29.6
|
1.0
|
CB
|
A:VAL256
|
4.9
|
26.4
|
1.0
|
HA
|
A:THR252
|
4.9
|
32.4
|
1.0
|
|
Reference:
S.Mazurkewich,
J.C.Navarro Poulsen,
J.Larsbrink,
L.Lo Leggio.
The Glucuronoyl Esterase OTCE15A H408A Variant From Opitutus Terrae To Be Published.
Page generated: Tue Oct 1 18:29:37 2024
|