Sodium in PDB 8dq2: X-Ray Crystal Structure of Hansschlegelia Quercus Lanmodulin (Lanm) with Lanthanum (III) Bound at pH 7
Protein crystallography data
The structure of X-Ray Crystal Structure of Hansschlegelia Quercus Lanmodulin (Lanm) with Lanthanum (III) Bound at pH 7, PDB code: 8dq2
was solved by
J.J.Jung,
C.-Y.Lin,
A.K.Boal,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
40.11 /
1.80
|
Space group
|
P 1 21 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
40.107,
108.658,
44.697,
90,
90.02,
90
|
R / Rfree (%)
|
19 /
20.9
|
Other elements in 8dq2:
The structure of X-Ray Crystal Structure of Hansschlegelia Quercus Lanmodulin (Lanm) with Lanthanum (III) Bound at pH 7 also contains other interesting chemical elements:
Sodium Binding Sites:
The binding sites of Sodium atom in the X-Ray Crystal Structure of Hansschlegelia Quercus Lanmodulin (Lanm) with Lanthanum (III) Bound at pH 7
(pdb code 8dq2). This binding sites where shown within
5.0 Angstroms radius around Sodium atom.
In total 4 binding sites of Sodium where determined in the
X-Ray Crystal Structure of Hansschlegelia Quercus Lanmodulin (Lanm) with Lanthanum (III) Bound at pH 7, PDB code: 8dq2:
Jump to Sodium binding site number:
1;
2;
3;
4;
Sodium binding site 1 out
of 4 in 8dq2
Go back to
Sodium Binding Sites List in 8dq2
Sodium binding site 1 out
of 4 in the X-Ray Crystal Structure of Hansschlegelia Quercus Lanmodulin (Lanm) with Lanthanum (III) Bound at pH 7
Mono view
Stereo pair view
|
A full contact list of Sodium with other atoms in the Na binding
site number 1 of X-Ray Crystal Structure of Hansschlegelia Quercus Lanmodulin (Lanm) with Lanthanum (III) Bound at pH 7 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Na204
b:28.0
occ:1.00
|
O
|
A:LYS113
|
2.3
|
35.1
|
1.0
|
OD1
|
A:ASN109
|
2.3
|
39.0
|
1.0
|
OD1
|
A:ASP107
|
2.4
|
20.3
|
1.0
|
OD1
|
A:ASP111
|
2.5
|
23.7
|
1.0
|
OE2
|
A:GLU118
|
2.5
|
33.3
|
1.0
|
OE1
|
A:GLU118
|
2.5
|
29.8
|
1.0
|
O
|
A:HOH322
|
2.7
|
28.9
|
1.0
|
CD
|
A:GLU118
|
2.9
|
30.8
|
1.0
|
CG
|
A:ASP111
|
3.3
|
25.4
|
1.0
|
CG
|
A:ASN109
|
3.4
|
37.1
|
1.0
|
C
|
A:LYS113
|
3.5
|
31.9
|
1.0
|
CG
|
A:ASP107
|
3.6
|
19.9
|
1.0
|
OD2
|
A:ASP111
|
3.6
|
25.9
|
1.0
|
ND2
|
A:ASN109
|
3.9
|
39.4
|
1.0
|
CA
|
A:ASP107
|
4.1
|
18.1
|
1.0
|
O
|
A:HOH349
|
4.2
|
36.9
|
1.0
|
N
|
A:LYS113
|
4.2
|
24.8
|
1.0
|
N
|
A:ALA108
|
4.3
|
29.9
|
1.0
|
OD2
|
A:ASP107
|
4.4
|
20.9
|
1.0
|
N
|
A:ASN109
|
4.4
|
33.4
|
1.0
|
N
|
A:ASP111
|
4.4
|
24.6
|
1.0
|
CG
|
A:GLU118
|
4.4
|
25.2
|
1.0
|
CA
|
A:LYS113
|
4.4
|
25.0
|
1.0
|
CB
|
A:ASP107
|
4.4
|
18.3
|
1.0
|
C
|
A:ASP107
|
4.4
|
19.8
|
1.0
|
N
|
A:LEU114
|
4.5
|
17.9
|
1.0
|
N
|
A:LYS110
|
4.6
|
42.4
|
1.0
|
CA
|
A:LEU114
|
4.6
|
17.3
|
1.0
|
CB
|
A:ASP111
|
4.6
|
25.8
|
1.0
|
CD2
|
A:LEU114
|
4.7
|
15.1
|
1.0
|
CB
|
A:ASN109
|
4.7
|
36.7
|
1.0
|
CB
|
A:LYS113
|
4.8
|
24.6
|
1.0
|
N
|
A:GLY112
|
4.9
|
32.4
|
1.0
|
CA
|
A:ASN109
|
4.9
|
36.5
|
1.0
|
CA
|
A:ASP111
|
4.9
|
25.1
|
1.0
|
|
Sodium binding site 2 out
of 4 in 8dq2
Go back to
Sodium Binding Sites List in 8dq2
Sodium binding site 2 out
of 4 in the X-Ray Crystal Structure of Hansschlegelia Quercus Lanmodulin (Lanm) with Lanthanum (III) Bound at pH 7
Mono view
Stereo pair view
|
A full contact list of Sodium with other atoms in the Na binding
site number 2 of X-Ray Crystal Structure of Hansschlegelia Quercus Lanmodulin (Lanm) with Lanthanum (III) Bound at pH 7 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Na205
b:28.0
occ:1.00
|
OD1
|
B:ASP111
|
2.4
|
30.7
|
1.0
|
O
|
B:LYS113
|
2.4
|
32.5
|
1.0
|
OE1
|
B:GLU118
|
2.5
|
29.6
|
1.0
|
OD1
|
B:ASP107
|
2.5
|
21.7
|
1.0
|
OE2
|
B:GLU118
|
2.6
|
32.3
|
1.0
|
CD
|
B:GLU118
|
2.9
|
29.8
|
1.0
|
O
|
B:HOH315
|
3.0
|
22.1
|
1.0
|
CG
|
B:ASP111
|
3.4
|
32.0
|
1.0
|
CB
|
B:ASN109
|
3.6
|
46.0
|
1.0
|
N
|
B:ASN109
|
3.6
|
43.0
|
1.0
|
CG
|
B:ASP107
|
3.6
|
21.3
|
1.0
|
C
|
B:LYS113
|
3.7
|
29.9
|
1.0
|
OD2
|
B:ASP111
|
3.8
|
32.8
|
1.0
|
CA
|
B:ASN109
|
4.0
|
46.5
|
1.0
|
CA
|
B:ASP107
|
4.1
|
18.9
|
1.0
|
N
|
B:ALA108
|
4.1
|
23.1
|
1.0
|
N
|
B:LYS110
|
4.1
|
41.2
|
1.0
|
C
|
B:ASP107
|
4.2
|
21.6
|
1.0
|
N
|
B:ASP111
|
4.2
|
28.1
|
1.0
|
N
|
B:LYS113
|
4.3
|
24.4
|
1.0
|
C
|
B:ASN109
|
4.4
|
46.3
|
1.0
|
CG
|
B:GLU118
|
4.4
|
27.4
|
1.0
|
CB
|
B:ASP107
|
4.4
|
17.4
|
1.0
|
CG
|
B:ASN109
|
4.5
|
54.6
|
1.0
|
OD2
|
B:ASP107
|
4.5
|
22.1
|
1.0
|
CA
|
B:LYS113
|
4.5
|
24.5
|
1.0
|
CB
|
B:ASP111
|
4.6
|
28.9
|
1.0
|
N
|
B:LEU114
|
4.6
|
18.7
|
1.0
|
C
|
B:ALA108
|
4.7
|
26.5
|
1.0
|
CA
|
B:LEU114
|
4.7
|
17.0
|
1.0
|
CD2
|
B:LEU114
|
4.8
|
15.0
|
1.0
|
OD1
|
B:ASN109
|
4.9
|
57.0
|
1.0
|
N
|
B:GLY112
|
4.9
|
30.7
|
1.0
|
CA
|
B:ASP111
|
4.9
|
28.4
|
1.0
|
CA
|
B:ALA108
|
4.9
|
24.0
|
1.0
|
CB
|
B:LYS113
|
4.9
|
26.3
|
1.0
|
O
|
B:ASP107
|
4.9
|
21.8
|
1.0
|
|
Sodium binding site 3 out
of 4 in 8dq2
Go back to
Sodium Binding Sites List in 8dq2
Sodium binding site 3 out
of 4 in the X-Ray Crystal Structure of Hansschlegelia Quercus Lanmodulin (Lanm) with Lanthanum (III) Bound at pH 7
Mono view
Stereo pair view
|
A full contact list of Sodium with other atoms in the Na binding
site number 3 of X-Ray Crystal Structure of Hansschlegelia Quercus Lanmodulin (Lanm) with Lanthanum (III) Bound at pH 7 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Na204
b:28.0
occ:1.00
|
O
|
C:LYS113
|
2.3
|
27.9
|
1.0
|
OD1
|
C:ASN109
|
2.4
|
49.5
|
1.0
|
OD1
|
C:ASP111
|
2.4
|
33.4
|
1.0
|
OD1
|
C:ASP107
|
2.4
|
32.5
|
1.0
|
OE2
|
C:GLU118
|
2.4
|
27.8
|
1.0
|
O
|
C:HOH325
|
2.6
|
21.3
|
1.0
|
OE1
|
C:GLU118
|
2.7
|
30.1
|
1.0
|
CD
|
C:GLU118
|
2.9
|
28.5
|
1.0
|
CG
|
C:ASP111
|
3.3
|
33.9
|
1.0
|
CG
|
C:ASN109
|
3.5
|
45.9
|
1.0
|
CG
|
C:ASP107
|
3.5
|
33.0
|
1.0
|
C
|
C:LYS113
|
3.5
|
21.4
|
1.0
|
OD2
|
C:ASP111
|
3.6
|
34.2
|
1.0
|
ND2
|
C:ASN109
|
4.0
|
43.7
|
1.0
|
N
|
C:LYS113
|
4.2
|
29.4
|
1.0
|
CA
|
C:ASP107
|
4.2
|
29.1
|
1.0
|
N
|
C:ASP111
|
4.3
|
34.4
|
1.0
|
OD2
|
C:ASP107
|
4.3
|
34.1
|
1.0
|
N
|
C:ALA108
|
4.3
|
28.7
|
1.0
|
CA
|
C:LYS113
|
4.4
|
22.6
|
1.0
|
N
|
C:ASN109
|
4.4
|
45.2
|
1.0
|
CG
|
C:GLU118
|
4.4
|
26.0
|
1.0
|
CB
|
C:ASP107
|
4.4
|
31.9
|
1.0
|
N
|
C:LEU114
|
4.5
|
22.6
|
1.0
|
C
|
C:ASP107
|
4.5
|
31.4
|
1.0
|
N
|
C:LYS110
|
4.5
|
44.4
|
1.0
|
CB
|
C:ASP111
|
4.5
|
32.9
|
1.0
|
CA
|
C:LEU114
|
4.6
|
22.8
|
1.0
|
CD2
|
C:LEU114
|
4.7
|
18.8
|
1.0
|
CB
|
C:ASN109
|
4.8
|
45.9
|
1.0
|
CB
|
C:LYS113
|
4.8
|
25.1
|
1.0
|
CA
|
C:ASP111
|
4.8
|
32.5
|
1.0
|
N
|
C:GLY112
|
4.9
|
30.2
|
1.0
|
CA
|
C:ASN109
|
4.9
|
47.3
|
1.0
|
C
|
C:ASN109
|
5.0
|
45.5
|
1.0
|
|
Sodium binding site 4 out
of 4 in 8dq2
Go back to
Sodium Binding Sites List in 8dq2
Sodium binding site 4 out
of 4 in the X-Ray Crystal Structure of Hansschlegelia Quercus Lanmodulin (Lanm) with Lanthanum (III) Bound at pH 7
Mono view
Stereo pair view
|
A full contact list of Sodium with other atoms in the Na binding
site number 4 of X-Ray Crystal Structure of Hansschlegelia Quercus Lanmodulin (Lanm) with Lanthanum (III) Bound at pH 7 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Na205
b:28.0
occ:1.00
|
O
|
D:LYS113
|
2.3
|
34.1
|
1.0
|
OD1
|
D:ASN109
|
2.3
|
37.8
|
1.0
|
OD1
|
D:ASP111
|
2.4
|
34.3
|
1.0
|
OD1
|
D:ASP107
|
2.4
|
30.9
|
1.0
|
OE2
|
D:GLU118
|
2.4
|
29.6
|
1.0
|
OE1
|
D:GLU118
|
2.7
|
27.7
|
1.0
|
CD
|
D:GLU118
|
2.9
|
27.2
|
1.0
|
O
|
D:HOH317
|
2.9
|
32.7
|
1.0
|
CG
|
D:ASP111
|
3.4
|
33.2
|
1.0
|
CG
|
D:ASN109
|
3.4
|
38.9
|
1.0
|
C
|
D:LYS113
|
3.5
|
28.1
|
1.0
|
CG
|
D:ASP107
|
3.5
|
29.9
|
1.0
|
OD2
|
D:ASP111
|
3.8
|
35.6
|
1.0
|
ND2
|
D:ASN109
|
4.0
|
42.8
|
1.0
|
CA
|
D:ASP107
|
4.1
|
30.0
|
1.0
|
N
|
D:LYS113
|
4.1
|
33.2
|
1.0
|
N
|
D:ALA108
|
4.1
|
30.0
|
1.0
|
N
|
D:ASN109
|
4.2
|
33.8
|
1.0
|
N
|
D:ASP111
|
4.2
|
36.3
|
1.0
|
C
|
D:ASP107
|
4.3
|
31.1
|
1.0
|
OD2
|
D:ASP107
|
4.3
|
32.5
|
1.0
|
CA
|
D:LYS113
|
4.3
|
29.9
|
1.0
|
CB
|
D:ASP107
|
4.4
|
30.6
|
1.0
|
CG
|
D:GLU118
|
4.4
|
25.1
|
1.0
|
N
|
D:LYS110
|
4.4
|
43.3
|
1.0
|
N
|
D:LEU114
|
4.5
|
27.1
|
1.0
|
CB
|
D:ASP111
|
4.6
|
34.3
|
1.0
|
CA
|
D:LEU114
|
4.6
|
25.7
|
1.0
|
CB
|
D:ASN109
|
4.7
|
35.7
|
1.0
|
CD2
|
D:LEU114
|
4.7
|
29.3
|
1.0
|
CA
|
D:ASN109
|
4.8
|
34.4
|
1.0
|
CB
|
D:LYS113
|
4.8
|
30.9
|
1.0
|
N
|
D:GLY112
|
4.8
|
31.5
|
1.0
|
CA
|
D:ASP111
|
4.8
|
34.5
|
1.0
|
C
|
D:ASN109
|
4.8
|
34.7
|
1.0
|
|
Reference:
J.A.Mattocks,
J.J.Jung,
C.Y.Lin,
Z.Dong,
N.H.Yennawar,
E.R.Featherston,
C.S.Kang-Yun,
T.A.Hamilton,
D.M.Park,
A.K.Boal,
J.A.Cotruvo.
Enhanced Rare-Earth Separation with A Metal-Sensitive Lanmodulin Dimer Nature V. 618 87 2023.
ISSN: ESSN 1476-4687
DOI: 10.1038/S41586-023-05945-5
Page generated: Wed Oct 9 11:32:12 2024
|