Manganese in PDB 7u7z: Human Dna Polymerase Eta-Dna-Dgmpnpp Ternary Mismatch Complex in 0.12 Mm MN2+ For 600S
Enzymatic activity of Human Dna Polymerase Eta-Dna-Dgmpnpp Ternary Mismatch Complex in 0.12 Mm MN2+ For 600S
All present enzymatic activity of Human Dna Polymerase Eta-Dna-Dgmpnpp Ternary Mismatch Complex in 0.12 Mm MN2+ For 600S:
2.7.7.7;
Protein crystallography data
The structure of Human Dna Polymerase Eta-Dna-Dgmpnpp Ternary Mismatch Complex in 0.12 Mm MN2+ For 600S, PDB code: 7u7z
was solved by
C.Chang,
Y.Gao,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
37.77 /
1.67
|
Space group
|
P 61
|
Cell size a, b, c (Å), α, β, γ (°)
|
98.215,
98.215,
82.157,
90,
90,
120
|
R / Rfree (%)
|
18.6 /
21.9
|
Manganese Binding Sites:
The binding sites of Manganese atom in the Human Dna Polymerase Eta-Dna-Dgmpnpp Ternary Mismatch Complex in 0.12 Mm MN2+ For 600S
(pdb code 7u7z). This binding sites where shown within
5.0 Angstroms radius around Manganese atom.
In total 2 binding sites of Manganese where determined in the
Human Dna Polymerase Eta-Dna-Dgmpnpp Ternary Mismatch Complex in 0.12 Mm MN2+ For 600S, PDB code: 7u7z:
Jump to Manganese binding site number:
1;
2;
Manganese binding site 1 out
of 2 in 7u7z
Go back to
Manganese Binding Sites List in 7u7z
Manganese binding site 1 out
of 2 in the Human Dna Polymerase Eta-Dna-Dgmpnpp Ternary Mismatch Complex in 0.12 Mm MN2+ For 600S
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 1 of Human Dna Polymerase Eta-Dna-Dgmpnpp Ternary Mismatch Complex in 0.12 Mm MN2+ For 600S within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mn501
b:30.4
occ:0.65
|
OD1
|
A:ASP115
|
2.2
|
29.2
|
0.9
|
OE1
|
A:GLU116
|
2.2
|
36.0
|
1.0
|
OD1
|
A:ASP13
|
2.3
|
34.1
|
1.0
|
O3'
|
P:DT8
|
2.3
|
31.1
|
0.2
|
O
|
A:HOH856
|
2.3
|
37.8
|
1.0
|
O1A
|
A:XG4505
|
2.4
|
22.0
|
0.8
|
O
|
A:HOH734
|
2.5
|
33.6
|
0.5
|
OD1
|
A:ASP115
|
2.8
|
26.1
|
0.1
|
CG
|
A:ASP115
|
3.2
|
25.9
|
0.1
|
CG
|
A:ASP115
|
3.2
|
25.6
|
0.9
|
CD
|
A:GLU116
|
3.3
|
39.8
|
1.0
|
C3'
|
P:DT8
|
3.3
|
30.4
|
0.2
|
CG
|
A:ASP13
|
3.5
|
25.9
|
1.0
|
PA
|
A:XG4505
|
3.5
|
23.6
|
0.8
|
OD2
|
A:ASP115
|
3.5
|
25.7
|
0.9
|
OD2
|
A:ASP115
|
3.6
|
22.5
|
0.1
|
MN
|
A:MN502
|
3.6
|
26.4
|
0.8
|
OG
|
A:SER113
|
3.8
|
32.5
|
1.0
|
O5'
|
A:XG4505
|
3.9
|
24.4
|
0.8
|
CB
|
A:ASP115
|
3.9
|
24.2
|
0.1
|
O2A
|
A:XG4505
|
4.0
|
25.8
|
0.8
|
CB
|
A:GLU116
|
4.0
|
30.3
|
1.0
|
OD2
|
A:ASP13
|
4.1
|
31.1
|
1.0
|
O
|
P:HOH101
|
4.1
|
34.1
|
0.3
|
OE2
|
A:GLU116
|
4.1
|
38.1
|
1.0
|
CG
|
A:GLU116
|
4.1
|
32.0
|
1.0
|
C5'
|
A:XG4505
|
4.2
|
22.3
|
0.8
|
O
|
A:HOH705
|
4.2
|
35.6
|
1.0
|
C4'
|
P:DT8
|
4.3
|
34.1
|
0.2
|
C2'
|
P:DT8
|
4.4
|
30.7
|
0.2
|
NZ
|
A:LYS224
|
4.4
|
40.2
|
1.0
|
C
|
A:ASP115
|
4.5
|
27.7
|
1.0
|
O
|
P:HOH117
|
4.6
|
33.7
|
0.5
|
CB
|
A:ASP13
|
4.6
|
22.1
|
1.0
|
CB
|
A:ASP115
|
4.6
|
24.5
|
0.9
|
O
|
A:ASP115
|
4.7
|
29.5
|
1.0
|
N
|
A:GLU116
|
4.7
|
23.6
|
1.0
|
CA
|
A:ASP115
|
4.7
|
24.6
|
0.1
|
O5'
|
P:DT8
|
4.7
|
34.7
|
0.2
|
O2G
|
A:XG4505
|
4.8
|
23.2
|
0.8
|
C5'
|
P:DT8
|
4.8
|
35.1
|
0.2
|
CB
|
A:SER113
|
4.9
|
30.3
|
1.0
|
N3A
|
A:XG4505
|
4.9
|
25.7
|
0.8
|
CA
|
A:ASP115
|
5.0
|
24.4
|
0.9
|
CA
|
A:GLU116
|
5.0
|
24.1
|
1.0
|
|
Manganese binding site 2 out
of 2 in 7u7z
Go back to
Manganese Binding Sites List in 7u7z
Manganese binding site 2 out
of 2 in the Human Dna Polymerase Eta-Dna-Dgmpnpp Ternary Mismatch Complex in 0.12 Mm MN2+ For 600S
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 2 of Human Dna Polymerase Eta-Dna-Dgmpnpp Ternary Mismatch Complex in 0.12 Mm MN2+ For 600S within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mn502
b:26.4
occ:0.85
|
O
|
A:MET14
|
2.2
|
23.6
|
1.0
|
OD2
|
A:ASP115
|
2.2
|
25.7
|
0.9
|
OD2
|
A:ASP13
|
2.2
|
31.1
|
1.0
|
O2G
|
A:XG4505
|
2.2
|
23.2
|
0.8
|
O1B
|
A:XG4505
|
2.3
|
23.2
|
0.8
|
O1A
|
A:XG4505
|
2.5
|
22.0
|
0.8
|
CG
|
A:ASP13
|
2.8
|
25.9
|
1.0
|
OD1
|
A:ASP13
|
2.9
|
34.1
|
1.0
|
CG
|
A:ASP115
|
3.2
|
25.6
|
0.9
|
PB
|
A:XG4505
|
3.3
|
23.4
|
0.8
|
C
|
A:MET14
|
3.3
|
20.1
|
1.0
|
PG
|
A:XG4505
|
3.5
|
24.1
|
0.8
|
PA
|
A:XG4505
|
3.6
|
23.6
|
0.8
|
MN
|
A:MN501
|
3.6
|
30.4
|
0.7
|
OD1
|
A:ASP115
|
3.7
|
29.2
|
0.9
|
O3B
|
A:XG4505
|
3.7
|
21.5
|
0.8
|
N3A
|
A:XG4505
|
3.8
|
25.7
|
0.8
|
N
|
A:MET14
|
3.8
|
19.0
|
1.0
|
O
|
A:HOH705
|
4.0
|
35.6
|
1.0
|
O3G
|
A:XG4505
|
4.0
|
24.1
|
0.8
|
OD2
|
A:ASP115
|
4.0
|
22.5
|
0.1
|
NZ
|
A:LYS231
|
4.1
|
26.8
|
1.0
|
CA
|
A:MET14
|
4.1
|
19.7
|
1.0
|
CB
|
A:ASP115
|
4.1
|
24.2
|
0.1
|
CB
|
A:ASP13
|
4.2
|
22.1
|
1.0
|
CG
|
A:ASP115
|
4.2
|
25.9
|
0.1
|
C
|
A:ASP13
|
4.2
|
19.3
|
1.0
|
C5'
|
A:XG4505
|
4.3
|
22.3
|
0.8
|
N
|
A:ASP15
|
4.3
|
19.7
|
1.0
|
O5'
|
A:XG4505
|
4.4
|
24.4
|
0.8
|
N
|
A:CYS16
|
4.5
|
23.6
|
1.0
|
CA
|
A:ASP15
|
4.5
|
20.5
|
1.0
|
CB
|
A:ASP115
|
4.5
|
24.5
|
0.9
|
O
|
A:HOH856
|
4.6
|
37.8
|
1.0
|
C
|
A:ASP15
|
4.6
|
25.1
|
1.0
|
O
|
A:ASP13
|
4.6
|
21.6
|
1.0
|
CA
|
A:ASP13
|
4.6
|
21.0
|
1.0
|
CB
|
A:MET14
|
4.6
|
21.1
|
1.0
|
O2B
|
A:XG4505
|
4.7
|
24.0
|
0.8
|
CE
|
A:LYS231
|
4.7
|
40.7
|
1.0
|
N
|
A:PHE17
|
4.7
|
20.2
|
1.0
|
O1G
|
A:XG4505
|
4.7
|
26.1
|
0.8
|
O
|
A:ASP115
|
4.8
|
29.5
|
1.0
|
O2A
|
A:XG4505
|
4.9
|
25.8
|
0.8
|
OD1
|
A:ASP115
|
4.9
|
26.1
|
0.1
|
CB
|
A:PHE17
|
5.0
|
18.1
|
1.0
|
|
Reference:
C.Chang,
C.Lee Luo,
Y.Gao.
In Crystallo Observation of Three Metal Ion Promoted Dna Polymerase Misincorporation. Nat Commun V. 13 2346 2022.
ISSN: ESSN 2041-1723
PubMed: 35487947
DOI: 10.1038/S41467-022-30005-3
Page generated: Sun Oct 6 10:45:20 2024
|