Manganese in PDB 6vf4: Dna Polymerase Mu, 8-Oxorgtp:at Reaction State Ternary Complex, 50 Mm MN2+ (30 Min)
Enzymatic activity of Dna Polymerase Mu, 8-Oxorgtp:at Reaction State Ternary Complex, 50 Mm MN2+ (30 Min)
All present enzymatic activity of Dna Polymerase Mu, 8-Oxorgtp:at Reaction State Ternary Complex, 50 Mm MN2+ (30 Min):
2.7.7.7;
Protein crystallography data
The structure of Dna Polymerase Mu, 8-Oxorgtp:at Reaction State Ternary Complex, 50 Mm MN2+ (30 Min), PDB code: 6vf4
was solved by
J.A.Jamsen,
S.H.Wilson,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
32.48 /
1.75
|
Space group
|
P 21 21 21
|
Cell size a, b, c (Å), α, β, γ (°)
|
60.085,
68.757,
110.531,
90,
90,
90
|
R / Rfree (%)
|
16.8 /
19.2
|
Other elements in 6vf4:
The structure of Dna Polymerase Mu, 8-Oxorgtp:at Reaction State Ternary Complex, 50 Mm MN2+ (30 Min) also contains other interesting chemical elements:
Manganese Binding Sites:
The binding sites of Manganese atom in the Dna Polymerase Mu, 8-Oxorgtp:at Reaction State Ternary Complex, 50 Mm MN2+ (30 Min)
(pdb code 6vf4). This binding sites where shown within
5.0 Angstroms radius around Manganese atom.
In total 5 binding sites of Manganese where determined in the
Dna Polymerase Mu, 8-Oxorgtp:at Reaction State Ternary Complex, 50 Mm MN2+ (30 Min), PDB code: 6vf4:
Jump to Manganese binding site number:
1;
2;
3;
4;
5;
Manganese binding site 1 out
of 5 in 6vf4
Go back to
Manganese Binding Sites List in 6vf4
Manganese binding site 1 out
of 5 in the Dna Polymerase Mu, 8-Oxorgtp:at Reaction State Ternary Complex, 50 Mm MN2+ (30 Min)
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 1 of Dna Polymerase Mu, 8-Oxorgtp:at Reaction State Ternary Complex, 50 Mm MN2+ (30 Min) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mn501
b:22.6
occ:1.00
|
OD2
|
A:ASP330
|
1.7
|
27.6
|
1.0
|
OP1
|
P:8GM5
|
1.7
|
19.7
|
0.4
|
OD2
|
A:ASP418
|
2.1
|
20.8
|
1.0
|
OD1
|
A:ASP332
|
2.2
|
21.7
|
1.0
|
O
|
P:HOH202
|
2.3
|
28.8
|
1.0
|
O1A
|
A:8GT511
|
2.7
|
18.4
|
0.6
|
P
|
P:8GM5
|
2.7
|
22.6
|
0.4
|
O3'
|
P:DA4
|
2.8
|
24.7
|
0.6
|
O3'
|
P:DA4
|
2.8
|
24.5
|
0.4
|
CG
|
A:ASP330
|
2.8
|
27.5
|
1.0
|
CG
|
A:ASP332
|
3.1
|
20.6
|
1.0
|
CG
|
A:ASP418
|
3.2
|
21.1
|
1.0
|
OD1
|
A:ASP330
|
3.2
|
26.2
|
1.0
|
OD2
|
A:ASP332
|
3.5
|
20.1
|
1.0
|
PA
|
A:8GT511
|
3.5
|
23.3
|
0.6
|
MN
|
A:MN502
|
3.5
|
20.7
|
1.0
|
OP2
|
P:8GM5
|
3.7
|
23.7
|
0.4
|
O2A
|
A:8GT511
|
3.8
|
25.1
|
0.6
|
CB
|
A:ASP418
|
3.8
|
18.9
|
1.0
|
C3'
|
P:DA4
|
3.9
|
24.6
|
0.6
|
C3'
|
P:DA4
|
3.9
|
24.9
|
0.4
|
O5'
|
A:8GT511
|
3.9
|
25.1
|
0.6
|
O5'
|
P:8GM5
|
4.0
|
24.6
|
0.4
|
C5'
|
P:DA4
|
4.0
|
23.3
|
0.4
|
C4'
|
P:DA4
|
4.1
|
24.3
|
0.4
|
C5'
|
P:DA4
|
4.1
|
23.7
|
0.6
|
OD1
|
A:ASP418
|
4.1
|
21.9
|
1.0
|
CB
|
A:ASP330
|
4.2
|
24.6
|
1.0
|
C4'
|
P:DA4
|
4.2
|
24.6
|
0.6
|
C5'
|
P:8GM5
|
4.4
|
24.1
|
0.4
|
CB
|
A:ASP332
|
4.4
|
18.0
|
1.0
|
C5'
|
A:8GT511
|
4.5
|
24.9
|
0.6
|
OP1
|
P:DA4
|
4.5
|
23.9
|
0.6
|
NH2
|
A:ARG416
|
4.6
|
20.1
|
1.0
|
OP1
|
P:DA4
|
4.7
|
24.0
|
0.4
|
O3G
|
A:8GT511
|
4.7
|
30.1
|
0.6
|
CZ3
|
A:TRP434
|
4.7
|
24.4
|
1.0
|
O5'
|
P:DA4
|
4.8
|
24.1
|
0.4
|
O5'
|
P:DA4
|
4.8
|
24.1
|
0.6
|
O
|
A:VAL331
|
4.8
|
18.6
|
1.0
|
O32
|
A:PPV506
|
4.9
|
30.5
|
0.1
|
O21
|
A:PPV506
|
4.9
|
25.7
|
0.4
|
O3A
|
A:8GT511
|
5.0
|
29.2
|
0.6
|
|
Manganese binding site 2 out
of 5 in 6vf4
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Manganese Binding Sites List in 6vf4
Manganese binding site 2 out
of 5 in the Dna Polymerase Mu, 8-Oxorgtp:at Reaction State Ternary Complex, 50 Mm MN2+ (30 Min)
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 2 of Dna Polymerase Mu, 8-Oxorgtp:at Reaction State Ternary Complex, 50 Mm MN2+ (30 Min) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mn502
b:20.7
occ:1.00
|
O1A
|
A:8GT511
|
1.6
|
18.4
|
0.6
|
O
|
A:HOH632
|
2.0
|
23.8
|
1.0
|
OD2
|
A:ASP332
|
2.1
|
20.1
|
1.0
|
OD1
|
A:ASP330
|
2.1
|
26.2
|
1.0
|
O32
|
A:PPV506
|
2.1
|
30.5
|
0.1
|
O1B
|
A:8GT511
|
2.2
|
27.9
|
0.6
|
O21
|
A:PPV506
|
2.2
|
25.7
|
0.4
|
O3G
|
A:8GT511
|
2.2
|
30.1
|
0.6
|
OP1
|
P:8GM5
|
2.6
|
19.7
|
0.4
|
PA
|
A:8GT511
|
3.0
|
23.3
|
0.6
|
CG
|
A:ASP332
|
3.1
|
20.6
|
1.0
|
CG
|
A:ASP330
|
3.1
|
27.5
|
1.0
|
P1
|
A:PPV506
|
3.2
|
28.8
|
0.4
|
PB
|
A:8GT511
|
3.2
|
28.3
|
0.6
|
O3A
|
A:8GT511
|
3.4
|
29.2
|
0.6
|
O31
|
A:PPV506
|
3.4
|
30.4
|
0.4
|
P2
|
A:PPV506
|
3.4
|
33.2
|
0.1
|
OD1
|
A:ASP332
|
3.5
|
21.7
|
1.0
|
PG
|
A:8GT511
|
3.5
|
32.7
|
0.6
|
MN
|
A:MN501
|
3.5
|
22.6
|
1.0
|
OD2
|
A:ASP330
|
3.5
|
27.6
|
1.0
|
OPP
|
A:PPV506
|
3.5
|
30.6
|
0.1
|
O3B
|
A:8GT511
|
3.8
|
33.5
|
0.6
|
P
|
P:8GM5
|
3.8
|
22.6
|
0.4
|
O2G
|
A:8GT511
|
4.0
|
35.3
|
0.6
|
O
|
A:ASP330
|
4.0
|
20.3
|
1.0
|
O5'
|
P:8GM5
|
4.1
|
24.6
|
0.4
|
O5'
|
A:8GT511
|
4.1
|
25.1
|
0.6
|
O2A
|
A:8GT511
|
4.1
|
25.1
|
0.6
|
O
|
A:HOH621
|
4.2
|
18.8
|
1.0
|
O12
|
A:PPV506
|
4.3
|
36.0
|
0.1
|
N
|
A:GLY320
|
4.3
|
17.2
|
1.0
|
C5'
|
A:8GT511
|
4.3
|
24.9
|
0.6
|
C
|
A:ASP330
|
4.3
|
20.7
|
1.0
|
CB
|
A:ASP332
|
4.4
|
18.0
|
1.0
|
CB
|
A:ASP330
|
4.4
|
24.6
|
1.0
|
O
|
A:HOH601
|
4.4
|
32.8
|
1.0
|
O22
|
A:PPV506
|
4.5
|
35.8
|
0.1
|
CA
|
A:GLY319
|
4.5
|
16.4
|
1.0
|
C5'
|
P:8GM5
|
4.5
|
24.1
|
0.4
|
O11
|
A:PPV506
|
4.5
|
31.3
|
0.4
|
O2B
|
A:8GT511
|
4.6
|
30.5
|
0.6
|
O
|
P:HOH202
|
4.6
|
28.8
|
1.0
|
O1G
|
A:8GT511
|
4.6
|
37.0
|
0.6
|
OP2
|
P:8GM5
|
4.7
|
23.7
|
0.4
|
CA
|
A:ASP330
|
4.7
|
22.8
|
1.0
|
N
|
A:ASP330
|
4.7
|
23.8
|
1.0
|
N
|
A:ASP332
|
4.8
|
15.8
|
1.0
|
N
|
A:VAL331
|
4.9
|
18.4
|
1.0
|
O3'
|
P:DA4
|
5.0
|
24.5
|
0.4
|
C
|
A:GLY319
|
5.0
|
16.8
|
1.0
|
C
|
A:VAL331
|
5.0
|
17.7
|
1.0
|
|
Manganese binding site 3 out
of 5 in 6vf4
Go back to
Manganese Binding Sites List in 6vf4
Manganese binding site 3 out
of 5 in the Dna Polymerase Mu, 8-Oxorgtp:at Reaction State Ternary Complex, 50 Mm MN2+ (30 Min)
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 3 of Dna Polymerase Mu, 8-Oxorgtp:at Reaction State Ternary Complex, 50 Mm MN2+ (30 Min) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mn503
b:55.1
occ:0.57
|
OP3
|
D:DG1
|
2.2
|
37.9
|
1.0
|
O
|
A:HOH695
|
2.4
|
60.0
|
1.0
|
ND1
|
A:HIS208
|
2.4
|
34.8
|
1.0
|
CE1
|
A:HIS208
|
3.2
|
34.8
|
1.0
|
CG
|
A:HIS208
|
3.4
|
33.4
|
1.0
|
P
|
D:DG1
|
3.4
|
33.6
|
1.0
|
OP1
|
D:DG1
|
3.7
|
33.7
|
1.0
|
CB
|
A:HIS208
|
3.8
|
29.4
|
1.0
|
O
|
D:HOH107
|
3.9
|
48.4
|
1.0
|
O
|
D:HOH104
|
4.1
|
51.0
|
1.0
|
OP2
|
D:DG1
|
4.1
|
35.1
|
1.0
|
NE2
|
A:HIS208
|
4.3
|
34.0
|
1.0
|
CD2
|
A:HIS208
|
4.4
|
33.7
|
1.0
|
NH2
|
A:ARG211
|
4.4
|
87.3
|
1.0
|
NH1
|
A:ARG211
|
4.6
|
88.7
|
1.0
|
O5'
|
D:DG1
|
4.6
|
30.4
|
1.0
|
CA
|
A:HIS208
|
4.7
|
29.1
|
1.0
|
C5'
|
D:DG1
|
5.0
|
28.4
|
1.0
|
|
Manganese binding site 4 out
of 5 in 6vf4
Go back to
Manganese Binding Sites List in 6vf4
Manganese binding site 4 out
of 5 in the Dna Polymerase Mu, 8-Oxorgtp:at Reaction State Ternary Complex, 50 Mm MN2+ (30 Min)
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 4 of Dna Polymerase Mu, 8-Oxorgtp:at Reaction State Ternary Complex, 50 Mm MN2+ (30 Min) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mn504
b:29.1
occ:0.57
|
O
|
A:HOH786
|
2.1
|
37.9
|
0.9
|
OE2
|
A:GLU386
|
2.2
|
36.1
|
1.0
|
O
|
A:HOH761
|
2.2
|
35.0
|
0.9
|
NE2
|
A:HIS459
|
2.3
|
40.0
|
1.0
|
O
|
T:HOH202
|
2.4
|
39.5
|
1.0
|
OE1
|
A:GLU386
|
2.7
|
42.9
|
1.0
|
CD
|
A:GLU386
|
2.8
|
39.0
|
1.0
|
CD2
|
A:HIS459
|
3.1
|
39.8
|
1.0
|
CE1
|
A:HIS459
|
3.4
|
41.1
|
1.0
|
O
|
A:HOH651
|
4.1
|
36.6
|
1.0
|
O
|
A:HOH612
|
4.3
|
29.5
|
1.0
|
O
|
A:HOH785
|
4.3
|
49.4
|
1.0
|
CG
|
A:GLU386
|
4.3
|
36.7
|
1.0
|
OP1
|
T:DC8
|
4.3
|
30.5
|
1.0
|
CG
|
A:HIS459
|
4.4
|
36.0
|
1.0
|
ND1
|
A:HIS459
|
4.5
|
39.2
|
1.0
|
OE1
|
A:GLN426
|
4.6
|
27.6
|
1.0
|
C5'
|
T:DC8
|
4.6
|
25.0
|
1.0
|
|
Manganese binding site 5 out
of 5 in 6vf4
Go back to
Manganese Binding Sites List in 6vf4
Manganese binding site 5 out
of 5 in the Dna Polymerase Mu, 8-Oxorgtp:at Reaction State Ternary Complex, 50 Mm MN2+ (30 Min)
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 5 of Dna Polymerase Mu, 8-Oxorgtp:at Reaction State Ternary Complex, 50 Mm MN2+ (30 Min) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
T:Mn101
b:70.0
occ:0.90
|
O
|
T:HOH201
|
2.4
|
51.6
|
1.0
|
O
|
T:HOH203
|
2.4
|
42.7
|
0.8
|
N7
|
T:DG2
|
2.8
|
34.9
|
1.0
|
C8
|
T:DG2
|
3.6
|
34.5
|
1.0
|
O
|
T:HOH206
|
3.8
|
39.7
|
1.0
|
C5
|
T:DG2
|
3.8
|
33.3
|
1.0
|
O6
|
T:DG2
|
4.0
|
31.7
|
1.0
|
C6
|
T:DG2
|
4.3
|
31.0
|
1.0
|
OP2
|
T:DG2
|
4.4
|
49.6
|
1.0
|
O6
|
T:DG3
|
4.4
|
27.6
|
1.0
|
N9
|
T:DG2
|
4.8
|
34.1
|
1.0
|
C2'
|
T:DC1
|
4.9
|
48.0
|
1.0
|
C6
|
T:DC1
|
4.9
|
40.6
|
1.0
|
C4
|
T:DG2
|
5.0
|
32.5
|
1.0
|
|
Reference:
J.A.Jamsen,
A.Sassa,
D.D.Shock,
W.A.Beard,
S.H.Wilson.
Dna Polymerase Mu, 8-Oxorgtp:at Reaction State Ternary Complex, 50 Mm MN2+ (30 Min) To Be Published.
Page generated: Sun Oct 6 07:30:45 2024
|