Zinc in PDB 3t9h: Kainate Bound to A Double Cysteine Mutant (A452C/S652C) of the Ligand Binding Domain of GLUA2
Protein crystallography data
The structure of Kainate Bound to A Double Cysteine Mutant (A452C/S652C) of the Ligand Binding Domain of GLUA2, PDB code: 3t9h
was solved by
A.H.Ahmed,
S.Wang,
H.H.Chuang,
R.E.Oswald,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
41.37 /
2.02
|
Space group
|
P 2 21 21
|
Cell size a, b, c (Å), α, β, γ (°)
|
47.841,
113.918,
164.786,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
18.7 /
23.5
|
Zinc Binding Sites:
The binding sites of Zinc atom in the Kainate Bound to A Double Cysteine Mutant (A452C/S652C) of the Ligand Binding Domain of GLUA2
(pdb code 3t9h). This binding sites where shown within
5.0 Angstroms radius around Zinc atom.
In total 5 binding sites of Zinc where determined in the
Kainate Bound to A Double Cysteine Mutant (A452C/S652C) of the Ligand Binding Domain of GLUA2, PDB code: 3t9h:
Jump to Zinc binding site number:
1;
2;
3;
4;
5;
Zinc binding site 1 out
of 5 in 3t9h
Go back to
Zinc Binding Sites List in 3t9h
Zinc binding site 1 out
of 5 in the Kainate Bound to A Double Cysteine Mutant (A452C/S652C) of the Ligand Binding Domain of GLUA2
 Mono view
 Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 1 of Kainate Bound to A Double Cysteine Mutant (A452C/S652C) of the Ligand Binding Domain of GLUA2 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Zn1
b:40.1
occ:1.00
|
NE2
|
B:HIS23
|
2.4
|
40.1
|
1.0
|
CD2
|
B:HIS23
|
3.1
|
38.7
|
1.0
|
CE1
|
B:HIS23
|
3.5
|
37.1
|
1.0
|
CG
|
B:HIS23
|
4.4
|
35.3
|
1.0
|
ND1
|
B:HIS23
|
4.5
|
35.0
|
1.0
|
CB
|
B:MET19
|
4.5
|
36.2
|
1.0
|
CG
|
B:MET19
|
4.7
|
36.1
|
1.0
|
|
Zinc binding site 2 out
of 5 in 3t9h
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Zinc Binding Sites List in 3t9h
Zinc binding site 2 out
of 5 in the Kainate Bound to A Double Cysteine Mutant (A452C/S652C) of the Ligand Binding Domain of GLUA2
 Mono view
 Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 2 of Kainate Bound to A Double Cysteine Mutant (A452C/S652C) of the Ligand Binding Domain of GLUA2 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Zn2
b:31.9
occ:1.00
|
NE2
|
B:HIS46
|
2.2
|
34.8
|
1.0
|
OE1
|
F:GLU166
|
2.3
|
29.9
|
1.0
|
OE2
|
F:GLU166
|
2.4
|
33.4
|
1.0
|
CD
|
F:GLU166
|
2.7
|
32.8
|
1.0
|
NZ
|
B:LYS45
|
2.7
|
44.2
|
1.0
|
OE1
|
B:GLU42
|
2.9
|
32.7
|
1.0
|
CE1
|
B:HIS46
|
3.0
|
40.2
|
1.0
|
CD2
|
B:HIS46
|
3.3
|
33.4
|
1.0
|
CD
|
B:GLU42
|
3.7
|
37.2
|
1.0
|
OE2
|
B:GLU42
|
3.8
|
32.3
|
1.0
|
CE
|
B:LYS45
|
4.1
|
43.0
|
1.0
|
CG
|
F:GLU166
|
4.2
|
31.3
|
1.0
|
ND1
|
B:HIS46
|
4.2
|
34.3
|
1.0
|
O
|
F:ALA165
|
4.2
|
29.1
|
1.0
|
CG
|
B:HIS46
|
4.4
|
33.6
|
1.0
|
CD
|
B:LYS45
|
4.4
|
44.2
|
1.0
|
N
|
F:SER168
|
4.5
|
31.8
|
1.0
|
CB
|
F:SER168
|
4.6
|
29.8
|
1.0
|
O
|
F:HOH313
|
4.7
|
39.5
|
1.0
|
CA
|
F:SER168
|
4.8
|
29.4
|
1.0
|
CD2
|
B:LEU241
|
4.8
|
31.6
|
1.0
|
CB
|
F:GLU166
|
5.0
|
31.7
|
1.0
|
|
Zinc binding site 3 out
of 5 in 3t9h
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Zinc Binding Sites List in 3t9h
Zinc binding site 3 out
of 5 in the Kainate Bound to A Double Cysteine Mutant (A452C/S652C) of the Ligand Binding Domain of GLUA2
 Mono view
 Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 3 of Kainate Bound to A Double Cysteine Mutant (A452C/S652C) of the Ligand Binding Domain of GLUA2 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Zn3
b:38.2
occ:1.00
|
CD
|
D:GLU24
|
2.3
|
49.5
|
1.0
|
CG
|
D:GLU24
|
2.6
|
47.7
|
1.0
|
NE2
|
D:HIS23
|
2.6
|
41.5
|
1.0
|
OE1
|
D:GLU24
|
2.6
|
54.6
|
1.0
|
OE2
|
D:GLU24
|
2.9
|
39.6
|
1.0
|
CD2
|
D:HIS23
|
3.1
|
41.0
|
1.0
|
CE1
|
D:HIS23
|
3.8
|
39.8
|
1.0
|
CB
|
D:GLU24
|
4.1
|
48.7
|
1.0
|
CG
|
D:HIS23
|
4.4
|
43.4
|
1.0
|
O
|
D:HOH563
|
4.5
|
55.1
|
1.0
|
O
|
D:HOH438
|
4.6
|
49.1
|
1.0
|
ND1
|
D:HIS23
|
4.7
|
39.7
|
1.0
|
CA
|
D:GLU24
|
4.9
|
49.9
|
1.0
|
|
Zinc binding site 4 out
of 5 in 3t9h
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Zinc Binding Sites List in 3t9h
Zinc binding site 4 out
of 5 in the Kainate Bound to A Double Cysteine Mutant (A452C/S652C) of the Ligand Binding Domain of GLUA2
 Mono view
 Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 4 of Kainate Bound to A Double Cysteine Mutant (A452C/S652C) of the Ligand Binding Domain of GLUA2 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Zn262
b:65.9
occ:1.00
|
NE2
|
D:HIS46
|
2.3
|
55.3
|
1.0
|
OE1
|
D:GLU42
|
2.4
|
46.4
|
1.0
|
CD2
|
D:HIS46
|
3.2
|
47.2
|
1.0
|
CD
|
D:GLU42
|
3.3
|
47.8
|
1.0
|
CE1
|
D:HIS46
|
3.3
|
55.8
|
1.0
|
OE2
|
D:GLU42
|
3.6
|
55.3
|
1.0
|
CD2
|
D:LEU241
|
4.0
|
37.8
|
1.0
|
NZ
|
D:LYS45
|
4.1
|
64.2
|
1.0
|
NE2
|
D:GLN244
|
4.2
|
50.0
|
1.0
|
CG
|
D:HIS46
|
4.4
|
48.0
|
1.0
|
CD
|
D:LYS45
|
4.4
|
49.5
|
1.0
|
ND1
|
D:HIS46
|
4.4
|
50.5
|
1.0
|
CG
|
D:GLU42
|
4.6
|
39.1
|
1.0
|
CD2
|
D:LEU246
|
4.7
|
44.6
|
1.0
|
CB
|
D:GLU42
|
4.9
|
36.4
|
1.0
|
CE
|
D:LYS45
|
4.9
|
57.2
|
1.0
|
|
Zinc binding site 5 out
of 5 in 3t9h
Go back to
Zinc Binding Sites List in 3t9h
Zinc binding site 5 out
of 5 in the Kainate Bound to A Double Cysteine Mutant (A452C/S652C) of the Ligand Binding Domain of GLUA2
 Mono view
 Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 5 of Kainate Bound to A Double Cysteine Mutant (A452C/S652C) of the Ligand Binding Domain of GLUA2 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
F:Zn262
b:38.4
occ:1.00
|
NE2
|
F:HIS46
|
2.3
|
33.1
|
1.0
|
OE1
|
F:GLU42
|
2.5
|
33.2
|
1.0
|
CE1
|
F:HIS46
|
3.1
|
37.5
|
1.0
|
NE2
|
F:GLN244
|
3.2
|
42.5
|
1.0
|
CD
|
F:GLU42
|
3.2
|
32.5
|
1.0
|
OE2
|
F:GLU42
|
3.3
|
36.2
|
1.0
|
CD2
|
F:HIS46
|
3.4
|
32.7
|
1.0
|
CD2
|
F:LEU241
|
3.5
|
31.7
|
1.0
|
NZ
|
F:LYS45
|
4.1
|
35.0
|
1.0
|
CD
|
F:GLN244
|
4.1
|
44.5
|
1.0
|
OE1
|
F:GLN244
|
4.3
|
48.1
|
1.0
|
ND1
|
F:HIS46
|
4.3
|
32.9
|
1.0
|
CG
|
F:HIS46
|
4.5
|
31.4
|
1.0
|
CG
|
F:GLU42
|
4.5
|
33.1
|
1.0
|
CE
|
F:LYS45
|
4.8
|
40.5
|
1.0
|
O
|
F:HOH519
|
4.8
|
42.9
|
1.0
|
|
Reference:
A.H.Ahmed,
S.Wang,
H.H.Chuang,
R.E.Oswald.
Mechanism of Ampa Receptor Activation By Partial Agonists: Disulfide Trapping of Closed Lobe Conformations. J.Biol.Chem. V. 286 35257 2011.
ISSN: ISSN 0021-9258
PubMed: 21846932
DOI: 10.1074/JBC.M111.269001
Page generated: Sat Oct 26 16:24:25 2024
|