Zinc in PDB 4nzg: Crystal Structure of the N-Terminal Domain of Moloney Murine Leukemia Virus Integrase, Northeast Structural Genomics Consortium Target OR3
Protein crystallography data
The structure of Crystal Structure of the N-Terminal Domain of Moloney Murine Leukemia Virus Integrase, Northeast Structural Genomics Consortium Target OR3, PDB code: 4nzg
was solved by
R.Guan,
M.Jiang,
H.Janjua,
M.Maglaqui,
L.Zhao,
R.Xiao,
T.B.Acton,
J.K.Everett,
M.Roth,
G.T.Montelione,
Northeast Structural Genomicsconsortium (Nesg),
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
45.07 /
2.15
|
Space group
|
P 1 21 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
44.659,
38.440,
135.275,
90.00,
91.70,
90.00
|
R / Rfree (%)
|
23.4 /
26.5
|
Zinc Binding Sites:
The binding sites of Zinc atom in the Crystal Structure of the N-Terminal Domain of Moloney Murine Leukemia Virus Integrase, Northeast Structural Genomics Consortium Target OR3
(pdb code 4nzg). This binding sites where shown within
5.0 Angstroms radius around Zinc atom.
In total 4 binding sites of Zinc where determined in the
Crystal Structure of the N-Terminal Domain of Moloney Murine Leukemia Virus Integrase, Northeast Structural Genomics Consortium Target OR3, PDB code: 4nzg:
Jump to Zinc binding site number:
1;
2;
3;
4;
Zinc binding site 1 out
of 4 in 4nzg
Go back to
Zinc Binding Sites List in 4nzg
Zinc binding site 1 out
of 4 in the Crystal Structure of the N-Terminal Domain of Moloney Murine Leukemia Virus Integrase, Northeast Structural Genomics Consortium Target OR3
 Mono view
 Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 1 of Crystal Structure of the N-Terminal Domain of Moloney Murine Leukemia Virus Integrase, Northeast Structural Genomics Consortium Target OR3 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn201
b:45.0
occ:1.00
|
ND1
|
A:HIS62
|
2.0
|
38.3
|
1.0
|
NE2
|
A:HIS58
|
2.1
|
51.8
|
1.0
|
SG
|
A:CYS98
|
2.2
|
42.6
|
1.0
|
SG
|
A:CYS95
|
2.3
|
45.5
|
1.0
|
CE1
|
A:HIS62
|
2.9
|
38.4
|
1.0
|
CD2
|
A:HIS58
|
3.0
|
50.6
|
1.0
|
CE1
|
A:HIS58
|
3.0
|
50.4
|
1.0
|
CG
|
A:HIS62
|
3.1
|
40.2
|
1.0
|
CB
|
A:CYS95
|
3.1
|
41.6
|
1.0
|
CB
|
A:CYS98
|
3.4
|
50.4
|
1.0
|
CB
|
A:HIS62
|
3.5
|
41.7
|
1.0
|
N
|
A:CYS98
|
3.8
|
44.6
|
1.0
|
CA
|
A:HIS62
|
3.9
|
44.4
|
1.0
|
CG
|
A:HIS58
|
4.1
|
52.0
|
1.0
|
ND1
|
A:HIS58
|
4.1
|
51.8
|
1.0
|
NE2
|
A:HIS62
|
4.1
|
40.4
|
1.0
|
CA
|
A:CYS98
|
4.1
|
45.8
|
1.0
|
CD2
|
A:HIS62
|
4.2
|
34.8
|
1.0
|
CA
|
A:CYS95
|
4.6
|
41.9
|
1.0
|
C
|
A:HIS62
|
4.6
|
41.3
|
1.0
|
O
|
A:HIS62
|
4.7
|
45.6
|
1.0
|
O
|
A:HIS58
|
4.7
|
43.2
|
1.0
|
CB
|
A:ALA97
|
4.8
|
44.6
|
1.0
|
C
|
A:ALA97
|
4.9
|
46.0
|
1.0
|
C
|
A:CYS95
|
5.0
|
48.2
|
1.0
|
|
Zinc binding site 2 out
of 4 in 4nzg
Go back to
Zinc Binding Sites List in 4nzg
Zinc binding site 2 out
of 4 in the Crystal Structure of the N-Terminal Domain of Moloney Murine Leukemia Virus Integrase, Northeast Structural Genomics Consortium Target OR3
 Mono view
 Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 2 of Crystal Structure of the N-Terminal Domain of Moloney Murine Leukemia Virus Integrase, Northeast Structural Genomics Consortium Target OR3 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Zn201
b:41.9
occ:1.00
|
ND1
|
B:HIS62
|
2.0
|
37.8
|
1.0
|
NE2
|
B:HIS58
|
2.1
|
51.6
|
1.0
|
SG
|
B:CYS98
|
2.3
|
42.1
|
1.0
|
SG
|
B:CYS95
|
2.3
|
39.5
|
1.0
|
CD2
|
B:HIS58
|
2.9
|
41.0
|
1.0
|
CE1
|
B:HIS62
|
2.9
|
43.5
|
1.0
|
CE1
|
B:HIS58
|
3.1
|
49.2
|
1.0
|
CG
|
B:HIS62
|
3.1
|
38.9
|
1.0
|
CB
|
B:CYS95
|
3.3
|
37.3
|
1.0
|
CB
|
B:CYS98
|
3.3
|
40.4
|
1.0
|
CB
|
B:HIS62
|
3.5
|
43.2
|
1.0
|
N
|
B:CYS98
|
3.7
|
42.1
|
1.0
|
CA
|
B:HIS62
|
3.9
|
44.2
|
1.0
|
CG
|
B:HIS58
|
4.1
|
47.8
|
1.0
|
CA
|
B:CYS98
|
4.1
|
40.0
|
1.0
|
NE2
|
B:HIS62
|
4.1
|
42.8
|
1.0
|
ND1
|
B:HIS58
|
4.1
|
50.9
|
1.0
|
CD2
|
B:HIS62
|
4.2
|
38.3
|
1.0
|
CB
|
B:ALA97
|
4.6
|
34.1
|
1.0
|
C
|
B:HIS62
|
4.6
|
49.2
|
1.0
|
CA
|
B:CYS95
|
4.7
|
39.9
|
1.0
|
O
|
B:HIS62
|
4.7
|
53.1
|
1.0
|
O
|
B:HIS58
|
4.7
|
41.7
|
1.0
|
C
|
B:ALA97
|
4.7
|
39.9
|
1.0
|
N
|
B:HIS62
|
5.0
|
38.4
|
1.0
|
|
Zinc binding site 3 out
of 4 in 4nzg
Go back to
Zinc Binding Sites List in 4nzg
Zinc binding site 3 out
of 4 in the Crystal Structure of the N-Terminal Domain of Moloney Murine Leukemia Virus Integrase, Northeast Structural Genomics Consortium Target OR3
 Mono view
 Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 3 of Crystal Structure of the N-Terminal Domain of Moloney Murine Leukemia Virus Integrase, Northeast Structural Genomics Consortium Target OR3 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Zn201
b:46.4
occ:1.00
|
CE1
|
C:HIS58
|
1.8
|
57.3
|
1.0
|
ND1
|
C:HIS62
|
2.0
|
37.5
|
1.0
|
NE2
|
C:HIS58
|
2.1
|
52.5
|
1.0
|
SG
|
C:CYS98
|
2.2
|
46.9
|
1.0
|
SG
|
C:CYS95
|
2.3
|
44.1
|
1.0
|
CE1
|
C:HIS62
|
2.9
|
42.4
|
1.0
|
ND1
|
C:HIS58
|
3.0
|
54.0
|
1.0
|
CG
|
C:HIS62
|
3.1
|
40.0
|
1.0
|
CB
|
C:CYS95
|
3.3
|
48.7
|
1.0
|
CB
|
C:CYS98
|
3.3
|
50.0
|
1.0
|
CD2
|
C:HIS58
|
3.4
|
47.6
|
1.0
|
CB
|
C:HIS62
|
3.5
|
44.3
|
1.0
|
CA
|
C:HIS62
|
3.8
|
48.4
|
1.0
|
N
|
C:CYS98
|
3.8
|
47.1
|
1.0
|
CG
|
C:HIS58
|
3.8
|
50.9
|
1.0
|
NE2
|
C:HIS62
|
4.1
|
41.2
|
1.0
|
CA
|
C:CYS98
|
4.1
|
49.0
|
1.0
|
CD2
|
C:HIS62
|
4.2
|
37.1
|
1.0
|
C
|
C:HIS62
|
4.5
|
52.9
|
1.0
|
O
|
C:HIS62
|
4.6
|
53.9
|
1.0
|
CA
|
C:CYS95
|
4.7
|
52.0
|
1.0
|
CB
|
C:ALA97
|
4.7
|
49.8
|
1.0
|
O
|
C:HIS58
|
4.7
|
51.5
|
1.0
|
C
|
C:ALA97
|
4.9
|
49.1
|
1.0
|
N
|
C:HIS62
|
4.9
|
46.4
|
1.0
|
|
Zinc binding site 4 out
of 4 in 4nzg
Go back to
Zinc Binding Sites List in 4nzg
Zinc binding site 4 out
of 4 in the Crystal Structure of the N-Terminal Domain of Moloney Murine Leukemia Virus Integrase, Northeast Structural Genomics Consortium Target OR3
 Mono view
 Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 4 of Crystal Structure of the N-Terminal Domain of Moloney Murine Leukemia Virus Integrase, Northeast Structural Genomics Consortium Target OR3 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Zn201
b:48.7
occ:1.00
|
ND1
|
D:HIS62
|
2.0
|
39.8
|
1.0
|
NE2
|
D:HIS58
|
2.0
|
48.1
|
1.0
|
SG
|
D:CYS95
|
2.3
|
48.3
|
1.0
|
SG
|
D:CYS98
|
2.3
|
48.8
|
1.0
|
CD2
|
D:HIS58
|
2.9
|
45.7
|
1.0
|
CE1
|
D:HIS62
|
2.9
|
48.5
|
1.0
|
CE1
|
D:HIS58
|
3.1
|
53.7
|
1.0
|
CG
|
D:HIS62
|
3.1
|
43.2
|
1.0
|
CB
|
D:CYS95
|
3.2
|
53.3
|
1.0
|
CB
|
D:CYS98
|
3.4
|
46.2
|
1.0
|
CB
|
D:HIS62
|
3.5
|
47.4
|
1.0
|
N
|
D:CYS98
|
3.8
|
52.7
|
1.0
|
CA
|
D:HIS62
|
3.8
|
51.4
|
1.0
|
CG
|
D:HIS58
|
4.0
|
51.2
|
1.0
|
NE2
|
D:HIS62
|
4.1
|
52.0
|
1.0
|
ND1
|
D:HIS58
|
4.1
|
52.1
|
1.0
|
CA
|
D:CYS98
|
4.1
|
50.7
|
1.0
|
CD2
|
D:HIS62
|
4.2
|
45.1
|
1.0
|
C
|
D:HIS62
|
4.6
|
52.3
|
1.0
|
CB
|
D:ALA97
|
4.6
|
50.9
|
1.0
|
CA
|
D:CYS95
|
4.6
|
53.3
|
1.0
|
O
|
D:HIS62
|
4.7
|
61.4
|
1.0
|
O
|
D:HIS58
|
4.7
|
53.3
|
1.0
|
C
|
D:ALA97
|
4.8
|
50.8
|
1.0
|
N
|
D:HIS62
|
5.0
|
52.0
|
1.0
|
|
Reference:
R.Guan,
M.Jiang,
H.Janjua,
M.Maglaqui,
L.Zhao,
R.Xiao,
T.B.Acton,
J.K.Everett,
M.Roth,
G.T.Montelione.
Northeast Structural Genomics Consortium Target OR3 To Be Published.
Page generated: Sun Oct 27 03:29:01 2024
|