Magnesium in PDB 3v6j: Replication of N2,3-Ethenoguanine By Dna Polymerases
Enzymatic activity of Replication of N2,3-Ethenoguanine By Dna Polymerases
All present enzymatic activity of Replication of N2,3-Ethenoguanine By Dna Polymerases:
2.7.7.7;
Protein crystallography data
The structure of Replication of N2,3-Ethenoguanine By Dna Polymerases, PDB code: 3v6j
was solved by
L.Zhao,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
29.84 /
2.30
|
Space group
|
P 1 21 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
52.700,
111.419,
98.807,
90.00,
102.57,
90.00
|
R / Rfree (%)
|
21 /
27.3
|
Other elements in 3v6j:
The structure of Replication of N2,3-Ethenoguanine By Dna Polymerases also contains other interesting chemical elements:
Magnesium Binding Sites:
The binding sites of Magnesium atom in the Replication of N2,3-Ethenoguanine By Dna Polymerases
(pdb code 3v6j). This binding sites where shown within
5.0 Angstroms radius around Magnesium atom.
In total 5 binding sites of Magnesium where determined in the
Replication of N2,3-Ethenoguanine By Dna Polymerases, PDB code: 3v6j:
Jump to Magnesium binding site number:
1;
2;
3;
4;
5;
Magnesium binding site 1 out
of 5 in 3v6j
Go back to
Magnesium Binding Sites List in 3v6j
Magnesium binding site 1 out
of 5 in the Replication of N2,3-Ethenoguanine By Dna Polymerases
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 1 of Replication of N2,3-Ethenoguanine By Dna Polymerases within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg402
b:19.7
occ:1.00
|
OE1
|
A:GLU106
|
2.2
|
45.9
|
1.0
|
O2A
|
A:DCP401
|
2.3
|
35.3
|
1.0
|
OD1
|
A:ASP105
|
2.4
|
29.6
|
1.0
|
OD2
|
A:ASP7
|
2.5
|
33.3
|
1.0
|
O
|
A:HOH559
|
2.5
|
43.9
|
1.0
|
OD1
|
A:ASP7
|
2.9
|
38.3
|
1.0
|
CG
|
A:ASP7
|
2.9
|
31.9
|
1.0
|
CG
|
A:ASP105
|
3.2
|
27.4
|
1.0
|
OD2
|
A:ASP105
|
3.2
|
32.8
|
1.0
|
MG
|
A:MG403
|
3.3
|
13.3
|
1.0
|
PA
|
A:DCP401
|
3.4
|
37.7
|
1.0
|
CD
|
A:GLU106
|
3.4
|
39.8
|
1.0
|
O5'
|
A:DCP401
|
3.9
|
46.4
|
1.0
|
O1A
|
A:DCP401
|
3.9
|
41.3
|
1.0
|
C5'
|
A:DCP401
|
4.0
|
37.5
|
1.0
|
CB
|
A:GLU106
|
4.2
|
34.6
|
1.0
|
CG
|
A:GLU106
|
4.3
|
35.8
|
1.0
|
OE2
|
A:GLU106
|
4.3
|
42.5
|
1.0
|
CB
|
A:ASP7
|
4.3
|
27.9
|
1.0
|
NZ
|
A:LYS152
|
4.5
|
40.3
|
1.0
|
NZ
|
A:LYS159
|
4.6
|
40.1
|
1.0
|
O1G
|
A:DCP401
|
4.6
|
26.6
|
1.0
|
CB
|
A:ASP105
|
4.6
|
27.2
|
1.0
|
O
|
A:ASP105
|
4.7
|
31.5
|
1.0
|
O3A
|
A:DCP401
|
4.7
|
28.3
|
1.0
|
OP2
|
P:DOC13
|
4.8
|
79.5
|
1.0
|
C
|
A:ASP105
|
4.8
|
27.9
|
1.0
|
O
|
A:HOH596
|
4.8
|
44.3
|
1.0
|
O1B
|
A:DCP401
|
4.8
|
24.7
|
1.0
|
CA
|
A:ASP7
|
4.9
|
24.6
|
1.0
|
|
Magnesium binding site 2 out
of 5 in 3v6j
Go back to
Magnesium Binding Sites List in 3v6j
Magnesium binding site 2 out
of 5 in the Replication of N2,3-Ethenoguanine By Dna Polymerases
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 2 of Replication of N2,3-Ethenoguanine By Dna Polymerases within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg403
b:13.3
occ:1.00
|
OD1
|
A:ASP7
|
2.0
|
38.3
|
1.0
|
O2A
|
A:DCP401
|
2.1
|
35.3
|
1.0
|
OD2
|
A:ASP105
|
2.1
|
32.8
|
1.0
|
O
|
A:HOH596
|
2.2
|
44.3
|
1.0
|
O
|
A:PHE8
|
2.2
|
24.2
|
1.0
|
O1G
|
A:DCP401
|
2.3
|
26.6
|
1.0
|
O1B
|
A:DCP401
|
2.3
|
24.7
|
1.0
|
CG
|
A:ASP7
|
3.2
|
31.9
|
1.0
|
MG
|
A:MG402
|
3.3
|
19.7
|
1.0
|
CG
|
A:ASP105
|
3.3
|
27.4
|
1.0
|
PA
|
A:DCP401
|
3.3
|
37.7
|
1.0
|
PB
|
A:DCP401
|
3.4
|
27.5
|
1.0
|
C
|
A:PHE8
|
3.4
|
25.6
|
1.0
|
PG
|
A:DCP401
|
3.5
|
33.9
|
1.0
|
O3A
|
A:DCP401
|
3.5
|
28.3
|
1.0
|
OD1
|
A:ASP105
|
3.7
|
29.6
|
1.0
|
OD2
|
A:ASP7
|
3.7
|
33.3
|
1.0
|
O3B
|
A:DCP401
|
3.8
|
32.2
|
1.0
|
N
|
A:PHE8
|
3.9
|
23.7
|
1.0
|
NZ
|
A:LYS159
|
4.1
|
40.1
|
1.0
|
C5'
|
A:DCP401
|
4.1
|
37.5
|
1.0
|
O2G
|
A:DCP401
|
4.2
|
27.7
|
1.0
|
C
|
A:ASP7
|
4.2
|
23.9
|
1.0
|
O5'
|
A:DCP401
|
4.2
|
46.4
|
1.0
|
CA
|
A:PHE8
|
4.3
|
24.0
|
1.0
|
N
|
A:ASP9
|
4.3
|
25.9
|
1.0
|
N
|
A:TYR10
|
4.4
|
24.3
|
1.0
|
CB
|
A:ASP7
|
4.4
|
27.9
|
1.0
|
CA
|
A:ASP9
|
4.5
|
25.0
|
1.0
|
O
|
A:ASP7
|
4.5
|
23.4
|
1.0
|
O1A
|
A:DCP401
|
4.5
|
41.3
|
1.0
|
CB
|
A:ASP105
|
4.5
|
27.2
|
1.0
|
C
|
A:ASP9
|
4.7
|
23.2
|
1.0
|
O3G
|
A:DCP401
|
4.7
|
36.1
|
1.0
|
N
|
A:PHE11
|
4.7
|
23.0
|
1.0
|
CA
|
A:ASP7
|
4.8
|
24.6
|
1.0
|
O2B
|
A:DCP401
|
4.8
|
33.1
|
1.0
|
O
|
A:ASP105
|
4.9
|
31.5
|
1.0
|
|
Magnesium binding site 3 out
of 5 in 3v6j
Go back to
Magnesium Binding Sites List in 3v6j
Magnesium binding site 3 out
of 5 in the Replication of N2,3-Ethenoguanine By Dna Polymerases
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 3 of Replication of N2,3-Ethenoguanine By Dna Polymerases within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
J:Mg402
b:43.0
occ:1.00
|
OE1
|
J:GLU106
|
2.0
|
65.6
|
1.0
|
O2A
|
J:DCP401
|
2.2
|
45.9
|
1.0
|
OD1
|
J:ASP7
|
2.3
|
59.0
|
1.0
|
OD1
|
J:ASP105
|
2.5
|
48.9
|
1.0
|
OD2
|
J:ASP105
|
2.5
|
50.0
|
1.0
|
OD2
|
J:ASP7
|
2.5
|
60.0
|
1.0
|
CG
|
J:ASP7
|
2.7
|
52.2
|
1.0
|
MG
|
J:MG403
|
2.8
|
28.0
|
1.0
|
CG
|
J:ASP105
|
2.9
|
49.8
|
1.0
|
CD
|
J:GLU106
|
3.0
|
60.3
|
1.0
|
CG
|
J:GLU106
|
3.3
|
59.3
|
1.0
|
PA
|
J:DCP401
|
3.4
|
65.1
|
1.0
|
O5'
|
J:DCP401
|
3.7
|
74.3
|
1.0
|
OP2
|
K:DOC13
|
4.0
|
61.2
|
1.0
|
CB
|
J:ASP7
|
4.1
|
51.3
|
1.0
|
O1A
|
J:DCP401
|
4.1
|
56.2
|
1.0
|
O1G
|
J:DCP401
|
4.2
|
51.8
|
1.0
|
OE2
|
J:GLU106
|
4.2
|
56.6
|
1.0
|
NZ
|
J:LYS152
|
4.3
|
59.1
|
1.0
|
CB
|
J:ASP105
|
4.4
|
49.5
|
1.0
|
O1B
|
J:DCP401
|
4.5
|
50.4
|
1.0
|
O
|
J:PHE8
|
4.5
|
42.3
|
1.0
|
CB
|
J:GLU106
|
4.7
|
55.2
|
1.0
|
O
|
J:ASP105
|
4.7
|
63.3
|
1.0
|
O3A
|
J:DCP401
|
4.7
|
65.4
|
1.0
|
CA
|
J:ASP7
|
4.8
|
48.8
|
1.0
|
OG
|
J:SER103
|
4.8
|
43.5
|
1.0
|
C
|
J:ASP105
|
4.8
|
55.4
|
1.0
|
|
Magnesium binding site 4 out
of 5 in 3v6j
Go back to
Magnesium Binding Sites List in 3v6j
Magnesium binding site 4 out
of 5 in the Replication of N2,3-Ethenoguanine By Dna Polymerases
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 4 of Replication of N2,3-Ethenoguanine By Dna Polymerases within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
J:Mg403
b:28.0
occ:1.00
|
O1G
|
J:DCP401
|
1.9
|
51.8
|
1.0
|
O2A
|
J:DCP401
|
2.1
|
45.9
|
1.0
|
OD1
|
J:ASP7
|
2.2
|
59.0
|
1.0
|
O
|
J:PHE8
|
2.2
|
42.3
|
1.0
|
OD2
|
J:ASP105
|
2.2
|
50.0
|
1.0
|
O1B
|
J:DCP401
|
2.5
|
50.4
|
1.0
|
MG
|
J:MG402
|
2.8
|
43.0
|
1.0
|
CG
|
J:ASP7
|
3.1
|
52.2
|
1.0
|
OD2
|
J:ASP7
|
3.3
|
60.0
|
1.0
|
PG
|
J:DCP401
|
3.4
|
46.5
|
1.0
|
CG
|
J:ASP105
|
3.4
|
49.8
|
1.0
|
C
|
J:PHE8
|
3.4
|
44.1
|
1.0
|
PA
|
J:DCP401
|
3.5
|
65.1
|
1.0
|
PB
|
J:DCP401
|
3.6
|
62.5
|
1.0
|
O3A
|
J:DCP401
|
3.9
|
65.4
|
1.0
|
O3B
|
J:DCP401
|
4.0
|
56.6
|
1.0
|
OD1
|
J:ASP105
|
4.0
|
48.9
|
1.0
|
O3G
|
J:DCP401
|
4.1
|
54.7
|
1.0
|
N
|
J:PHE8
|
4.2
|
46.8
|
1.0
|
N
|
J:ASP9
|
4.3
|
42.1
|
1.0
|
CA
|
J:ASP9
|
4.3
|
41.3
|
1.0
|
CA
|
J:PHE8
|
4.4
|
45.5
|
1.0
|
CB
|
J:ASP7
|
4.4
|
51.3
|
1.0
|
N
|
J:TYR10
|
4.4
|
41.4
|
1.0
|
O5'
|
J:DCP401
|
4.4
|
74.3
|
1.0
|
C
|
J:ASP7
|
4.4
|
46.7
|
1.0
|
O2G
|
J:DCP401
|
4.4
|
52.2
|
1.0
|
CB
|
J:ASP105
|
4.4
|
49.5
|
1.0
|
O1A
|
J:DCP401
|
4.6
|
56.2
|
1.0
|
C
|
J:ASP9
|
4.6
|
42.0
|
1.0
|
N
|
J:PHE11
|
4.8
|
38.7
|
1.0
|
OE1
|
J:GLU106
|
4.8
|
65.6
|
1.0
|
CA
|
J:ASP7
|
4.8
|
48.8
|
1.0
|
O
|
J:ASP7
|
4.8
|
47.4
|
1.0
|
CB
|
J:PHE11
|
5.0
|
41.0
|
1.0
|
O2B
|
J:DCP401
|
5.0
|
72.1
|
1.0
|
|
Magnesium binding site 5 out
of 5 in 3v6j
Go back to
Magnesium Binding Sites List in 3v6j
Magnesium binding site 5 out
of 5 in the Replication of N2,3-Ethenoguanine By Dna Polymerases
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 5 of Replication of N2,3-Ethenoguanine By Dna Polymerases within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
K:Mg101
b:49.6
occ:1.00
|
O1A
|
J:DCP401
|
2.7
|
56.2
|
1.0
|
OP1
|
K:DOC13
|
3.8
|
63.9
|
1.0
|
OP2
|
K:DOC13
|
3.9
|
61.2
|
1.0
|
PA
|
J:DCP401
|
4.0
|
65.1
|
1.0
|
O5'
|
J:DCP401
|
4.2
|
74.3
|
1.0
|
P
|
K:DOC13
|
4.3
|
69.2
|
1.0
|
O
|
J:HOH503
|
4.3
|
69.2
|
1.0
|
C5'
|
J:DCP401
|
4.5
|
72.8
|
1.0
|
O
|
J:HOH525
|
4.7
|
47.2
|
1.0
|
NZ
|
J:LYS152
|
4.8
|
59.1
|
1.0
|
O2A
|
J:DCP401
|
4.9
|
45.9
|
1.0
|
|
Reference:
L.Zhao,
P.P.Christov,
I.D.Kozekov,
M.G.Pence,
P.S.Pallan,
C.J.Rizzo,
M.Egli,
F.P.Guengerich.
Replication of N(2) ,3-Ethenoguanine By Dna Polymerases. Angew.Chem.Int.Ed.Engl. V. 51 5466 2012.
ISSN: ISSN 1433-7851
PubMed: 22488769
DOI: 10.1002/ANIE.201109004
Page generated: Thu Aug 15 12:45:11 2024
|