Zinc in PDB 5k81: Crystal Structure of A Primate APOBEC3G N-Terminal Domain
Protein crystallography data
The structure of Crystal Structure of A Primate APOBEC3G N-Terminal Domain, PDB code: 5k81
was solved by
X.Xiao,
S.-X.Li,
H.Yang,
X.S.Chen,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
46.01 /
2.01
|
Space group
|
P 1 21 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
106.213,
81.297,
106.298,
90.00,
120.03,
90.00
|
R / Rfree (%)
|
18.8 /
22.3
|
Zinc Binding Sites:
The binding sites of Zinc atom in the Crystal Structure of A Primate APOBEC3G N-Terminal Domain
(pdb code 5k81). This binding sites where shown within
5.0 Angstroms radius around Zinc atom.
In total 6 binding sites of Zinc where determined in the
Crystal Structure of A Primate APOBEC3G N-Terminal Domain, PDB code: 5k81:
Jump to Zinc binding site number:
1;
2;
3;
4;
5;
6;
Zinc binding site 1 out
of 6 in 5k81
Go back to
Zinc Binding Sites List in 5k81
Zinc binding site 1 out
of 6 in the Crystal Structure of A Primate APOBEC3G N-Terminal Domain
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 A Primate APOBEC3G N-Terminal Domain within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn401
b:26.8
occ:1.00
|
O
|
A:HOH538
|
2.0
|
23.6
|
1.0
|
ND1
|
A:HIS65
|
2.1
|
35.4
|
1.0
|
SG
|
A:CYS100
|
2.3
|
25.6
|
1.0
|
SG
|
A:CYS97
|
2.3
|
27.7
|
1.0
|
CE1
|
A:HIS65
|
3.0
|
35.5
|
1.0
|
CG
|
A:HIS65
|
3.2
|
31.4
|
1.0
|
CB
|
A:CYS100
|
3.2
|
22.9
|
1.0
|
CB
|
A:CYS97
|
3.4
|
29.2
|
1.0
|
CB
|
A:HIS65
|
3.6
|
26.8
|
1.0
|
N
|
A:CYS97
|
3.8
|
23.5
|
1.0
|
N
|
A:CYS100
|
4.1
|
22.9
|
1.0
|
CA
|
A:CYS97
|
4.1
|
23.8
|
1.0
|
OE2
|
A:GLU67
|
4.1
|
36.0
|
1.0
|
NE2
|
A:HIS65
|
4.2
|
37.2
|
1.0
|
OE1
|
A:GLU67
|
4.2
|
27.2
|
1.0
|
CA
|
A:CYS100
|
4.2
|
24.5
|
1.0
|
CD2
|
A:HIS65
|
4.3
|
34.1
|
1.0
|
CB
|
A:ALA62
|
4.3
|
36.0
|
1.0
|
CD
|
A:GLU67
|
4.4
|
26.7
|
1.0
|
O
|
A:CYS97
|
4.6
|
25.1
|
1.0
|
C
|
A:CYS97
|
4.6
|
22.8
|
1.0
|
CA
|
A:ALA62
|
4.7
|
39.5
|
1.0
|
O
|
A:ALA62
|
4.8
|
36.4
|
1.0
|
C
|
A:PRO96
|
4.9
|
26.4
|
1.0
|
|
Zinc binding site 2 out
of 6 in 5k81
Go back to
Zinc Binding Sites List in 5k81
Zinc binding site 2 out
of 6 in the Crystal Structure of A Primate APOBEC3G N-Terminal Domain
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 A Primate APOBEC3G N-Terminal Domain within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Zn401
b:25.0
occ:1.00
|
O
|
B:HOH546
|
1.9
|
21.9
|
1.0
|
ND1
|
B:HIS65
|
2.1
|
33.5
|
1.0
|
SG
|
B:CYS100
|
2.2
|
25.7
|
1.0
|
SG
|
B:CYS97
|
2.3
|
27.2
|
1.0
|
CE1
|
B:HIS65
|
3.0
|
37.3
|
1.0
|
CG
|
B:HIS65
|
3.2
|
31.3
|
1.0
|
CB
|
B:CYS100
|
3.2
|
22.5
|
1.0
|
CB
|
B:CYS97
|
3.4
|
29.1
|
1.0
|
O
|
B:HOH598
|
3.4
|
38.8
|
1.0
|
CB
|
B:HIS65
|
3.6
|
25.5
|
1.0
|
N
|
B:CYS97
|
3.8
|
25.1
|
1.0
|
N
|
B:CYS100
|
4.0
|
23.3
|
1.0
|
OE2
|
B:GLU67
|
4.1
|
37.1
|
1.0
|
CA
|
B:CYS97
|
4.1
|
25.9
|
1.0
|
NE2
|
B:HIS65
|
4.1
|
36.8
|
1.0
|
OE1
|
B:GLU67
|
4.2
|
28.4
|
1.0
|
CA
|
B:CYS100
|
4.2
|
23.9
|
1.0
|
CD2
|
B:HIS65
|
4.2
|
33.5
|
1.0
|
CB
|
B:ALA62
|
4.3
|
36.8
|
1.0
|
CD
|
B:GLU67
|
4.3
|
28.5
|
1.0
|
O
|
B:HOH551
|
4.5
|
38.7
|
1.0
|
O
|
B:CYS97
|
4.6
|
26.1
|
1.0
|
C
|
B:CYS97
|
4.6
|
25.8
|
1.0
|
CA
|
B:ALA62
|
4.7
|
39.2
|
1.0
|
O
|
B:ALA62
|
4.8
|
33.8
|
1.0
|
C
|
B:PRO96
|
4.9
|
27.0
|
1.0
|
|
Zinc binding site 3 out
of 6 in 5k81
Go back to
Zinc Binding Sites List in 5k81
Zinc binding site 3 out
of 6 in the Crystal Structure of A Primate APOBEC3G N-Terminal Domain
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 A Primate APOBEC3G N-Terminal Domain within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Zn401
b:26.3
occ:1.00
|
O
|
C:HOH561
|
1.9
|
22.1
|
1.0
|
ND1
|
C:HIS65
|
2.0
|
33.9
|
1.0
|
SG
|
C:CYS97
|
2.2
|
26.6
|
1.0
|
SG
|
C:CYS100
|
2.3
|
27.4
|
1.0
|
CE1
|
C:HIS65
|
2.9
|
37.2
|
1.0
|
CG
|
C:HIS65
|
3.1
|
30.2
|
1.0
|
CB
|
C:CYS100
|
3.2
|
23.5
|
1.0
|
CB
|
C:CYS97
|
3.4
|
28.8
|
1.0
|
O
|
C:HOH600
|
3.5
|
44.1
|
1.0
|
CB
|
C:HIS65
|
3.5
|
24.7
|
1.0
|
N
|
C:CYS97
|
3.8
|
23.3
|
1.0
|
NE2
|
C:HIS65
|
4.0
|
39.1
|
1.0
|
N
|
C:CYS100
|
4.1
|
21.8
|
1.0
|
CA
|
C:CYS97
|
4.1
|
24.6
|
1.0
|
OE1
|
C:GLU67
|
4.1
|
26.9
|
1.0
|
CD2
|
C:HIS65
|
4.2
|
37.1
|
1.0
|
OE2
|
C:GLU67
|
4.2
|
36.6
|
1.0
|
CA
|
C:CYS100
|
4.2
|
24.5
|
1.0
|
CD
|
C:GLU67
|
4.4
|
27.8
|
1.0
|
O
|
C:HOH556
|
4.5
|
39.3
|
1.0
|
O
|
C:CYS97
|
4.6
|
23.3
|
1.0
|
C
|
C:CYS97
|
4.6
|
25.5
|
1.0
|
CA
|
C:ALA62
|
4.7
|
44.5
|
1.0
|
O
|
C:ALA62
|
4.8
|
37.9
|
1.0
|
C
|
C:PRO96
|
4.9
|
26.2
|
1.0
|
|
Zinc binding site 4 out
of 6 in 5k81
Go back to
Zinc Binding Sites List in 5k81
Zinc binding site 4 out
of 6 in the Crystal Structure of A Primate APOBEC3G N-Terminal Domain
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 A Primate APOBEC3G N-Terminal Domain within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Zn401
b:36.7
occ:1.00
|
SG
|
D:CYS100
|
2.0
|
37.6
|
1.0
|
ND1
|
D:HIS65
|
2.0
|
46.0
|
1.0
|
O
|
D:HOH536
|
2.2
|
30.4
|
1.0
|
SG
|
D:CYS97
|
2.4
|
35.6
|
1.0
|
CE1
|
D:HIS65
|
3.0
|
45.0
|
1.0
|
CG
|
D:HIS65
|
3.1
|
39.6
|
1.0
|
CB
|
D:CYS100
|
3.1
|
36.4
|
1.0
|
CB
|
D:HIS65
|
3.4
|
36.6
|
1.0
|
CB
|
D:CYS97
|
3.4
|
39.3
|
1.0
|
N
|
D:CYS97
|
3.8
|
35.3
|
1.0
|
OE2
|
D:GLU67
|
3.8
|
40.7
|
1.0
|
N
|
D:CYS100
|
4.1
|
37.2
|
1.0
|
NE2
|
D:HIS65
|
4.1
|
48.9
|
1.0
|
CA
|
D:CYS97
|
4.1
|
39.2
|
1.0
|
CD2
|
D:HIS65
|
4.2
|
42.8
|
1.0
|
CA
|
D:CYS100
|
4.2
|
31.9
|
1.0
|
CD
|
D:GLU67
|
4.2
|
29.5
|
1.0
|
OE1
|
D:GLU67
|
4.2
|
39.9
|
1.0
|
CB
|
D:ALA62
|
4.6
|
50.3
|
1.0
|
O
|
D:CYS97
|
4.6
|
33.7
|
1.0
|
C
|
D:CYS97
|
4.7
|
32.5
|
1.0
|
O
|
D:ALA62
|
4.9
|
47.5
|
1.0
|
CA
|
D:HIS65
|
4.9
|
38.0
|
1.0
|
O
|
D:HOH528
|
4.9
|
35.9
|
1.0
|
C
|
D:PRO96
|
4.9
|
34.7
|
1.0
|
CA
|
D:ALA62
|
5.0
|
54.7
|
1.0
|
|
Zinc binding site 5 out
of 6 in 5k81
Go back to
Zinc Binding Sites List in 5k81
Zinc binding site 5 out
of 6 in the Crystal Structure of A Primate APOBEC3G N-Terminal Domain
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 5 of Crystal Structure of A Primate APOBEC3G N-Terminal Domain within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Zn401
b:37.6
occ:1.00
|
SG
|
E:CYS100
|
2.0
|
35.4
|
1.0
|
ND1
|
E:HIS65
|
2.0
|
48.5
|
1.0
|
O
|
E:HOH548
|
2.1
|
33.8
|
1.0
|
SG
|
E:CYS97
|
2.4
|
35.9
|
1.0
|
CE1
|
E:HIS65
|
3.0
|
49.0
|
1.0
|
CG
|
E:HIS65
|
3.0
|
39.9
|
1.0
|
CB
|
E:CYS100
|
3.1
|
36.0
|
1.0
|
CB
|
E:HIS65
|
3.3
|
35.7
|
1.0
|
CB
|
E:CYS97
|
3.5
|
38.5
|
1.0
|
N
|
E:CYS97
|
3.8
|
34.6
|
1.0
|
OE2
|
E:GLU67
|
3.9
|
43.4
|
1.0
|
NE2
|
E:HIS65
|
4.1
|
50.0
|
1.0
|
N
|
E:CYS100
|
4.1
|
38.5
|
1.0
|
OE1
|
E:GLU67
|
4.1
|
36.9
|
1.0
|
CD2
|
E:HIS65
|
4.1
|
41.3
|
1.0
|
CA
|
E:CYS97
|
4.2
|
37.4
|
1.0
|
CA
|
E:CYS100
|
4.2
|
29.9
|
1.0
|
CD
|
E:GLU67
|
4.2
|
31.9
|
1.0
|
O
|
E:CYS97
|
4.7
|
32.4
|
1.0
|
C
|
E:CYS97
|
4.7
|
31.6
|
1.0
|
CB
|
E:ALA62
|
4.8
|
54.0
|
1.0
|
O
|
E:ALA62
|
4.8
|
46.4
|
1.0
|
CA
|
E:HIS65
|
4.9
|
40.7
|
1.0
|
C
|
E:PRO96
|
4.9
|
33.9
|
1.0
|
|
Zinc binding site 6 out
of 6 in 5k81
Go back to
Zinc Binding Sites List in 5k81
Zinc binding site 6 out
of 6 in the Crystal Structure of A Primate APOBEC3G N-Terminal Domain
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 6 of Crystal Structure of A Primate APOBEC3G N-Terminal Domain within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
F:Zn401
b:36.9
occ:1.00
|
SG
|
F:CYS100
|
1.9
|
34.6
|
1.0
|
ND1
|
F:HIS65
|
2.0
|
44.7
|
1.0
|
O
|
F:HOH541
|
2.1
|
33.2
|
1.0
|
SG
|
F:CYS97
|
2.4
|
36.1
|
1.0
|
CE1
|
F:HIS65
|
3.0
|
48.0
|
1.0
|
CG
|
F:HIS65
|
3.0
|
39.8
|
1.0
|
CB
|
F:CYS100
|
3.2
|
35.7
|
1.0
|
CB
|
F:HIS65
|
3.3
|
34.5
|
1.0
|
CB
|
F:CYS97
|
3.5
|
38.1
|
1.0
|
N
|
F:CYS97
|
3.8
|
36.9
|
1.0
|
OE1
|
F:GLU67
|
3.9
|
39.5
|
1.0
|
NE2
|
F:HIS65
|
4.1
|
49.5
|
1.0
|
CD2
|
F:HIS65
|
4.1
|
44.0
|
1.0
|
N
|
F:CYS100
|
4.1
|
38.2
|
1.0
|
CA
|
F:CYS97
|
4.2
|
37.2
|
1.0
|
OE2
|
F:GLU67
|
4.2
|
34.9
|
1.0
|
CA
|
F:CYS100
|
4.2
|
30.6
|
1.0
|
CD
|
F:GLU67
|
4.3
|
33.2
|
1.0
|
CB
|
F:ALA62
|
4.6
|
54.4
|
1.0
|
O
|
F:CYS97
|
4.7
|
33.3
|
1.0
|
C
|
F:CYS97
|
4.7
|
34.1
|
1.0
|
O
|
F:ALA62
|
4.8
|
75.5
|
1.0
|
CA
|
F:HIS65
|
4.8
|
39.1
|
1.0
|
CA
|
F:ALA62
|
4.9
|
62.9
|
1.0
|
C
|
F:PRO96
|
4.9
|
34.1
|
1.0
|
O
|
F:HOH525
|
5.0
|
38.1
|
1.0
|
|
Reference:
X.Xiao,
S.X.Li,
H.Yang,
X.S.Chen.
Crystal Structures of APOBEC3G N-Domain Alone and Its Complex with Dna. Nat Commun V. 7 12193 2016.
ISSN: ESSN 2041-1723
PubMed: 27480941
DOI: 10.1038/NCOMMS12193
Page generated: Sun Oct 27 20:09:38 2024
|