Manganese in PDB 5hri: The Crystal Structure of Asfvpolx:DNA1 Binary Complex
Protein crystallography data
The structure of The Crystal Structure of Asfvpolx:DNA1 Binary Complex, PDB code: 5hri
was solved by
Y.Q.Chen,
J.Zhang,
J.H.Gan,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
29.36 /
2.20
|
Space group
|
P 21 21 2
|
Cell size a, b, c (Å), α, β, γ (°)
|
124.770,
71.273,
86.922,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
20.7 /
25.5
|
Manganese Binding Sites:
The binding sites of Manganese atom in the The Crystal Structure of Asfvpolx:DNA1 Binary Complex
(pdb code 5hri). This binding sites where shown within
5.0 Angstroms radius around Manganese atom.
In total 4 binding sites of Manganese where determined in the
The Crystal Structure of Asfvpolx:DNA1 Binary Complex, PDB code: 5hri:
Jump to Manganese binding site number:
1;
2;
3;
4;
Manganese binding site 1 out
of 4 in 5hri
Go back to
Manganese Binding Sites List in 5hri
Manganese binding site 1 out
of 4 in the The Crystal Structure of Asfvpolx:DNA1 Binary Complex
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 1 of The Crystal Structure of Asfvpolx:DNA1 Binary Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mn202
b:58.6
occ:1.00
|
OD1
|
A:ASP49
|
2.0
|
51.5
|
1.0
|
O2B
|
A:DGT201
|
2.0
|
53.0
|
1.0
|
O2G
|
A:DGT201
|
2.0
|
53.8
|
1.0
|
OD2
|
A:ASP51
|
2.0
|
47.2
|
1.0
|
O2A
|
A:DGT201
|
2.1
|
44.8
|
1.0
|
O
|
A:HOH301
|
2.2
|
53.8
|
1.0
|
CG
|
A:ASP49
|
3.0
|
53.0
|
1.0
|
MN
|
A:MN203
|
3.1
|
50.7
|
0.2
|
CG
|
A:ASP51
|
3.1
|
46.4
|
1.0
|
PB
|
A:DGT201
|
3.2
|
44.4
|
1.0
|
PA
|
A:DGT201
|
3.2
|
37.4
|
1.0
|
OD2
|
A:ASP49
|
3.3
|
58.3
|
1.0
|
PG
|
A:DGT201
|
3.3
|
43.5
|
1.0
|
O3A
|
A:DGT201
|
3.4
|
40.4
|
1.0
|
OD1
|
A:ASP51
|
3.6
|
49.9
|
1.0
|
O3B
|
A:DGT201
|
3.7
|
44.2
|
1.0
|
OG
|
A:SER39
|
3.9
|
46.5
|
1.0
|
O
|
A:HOH309
|
3.9
|
66.0
|
1.0
|
O3G
|
A:DGT201
|
4.0
|
47.0
|
1.0
|
C5'
|
A:DGT201
|
4.1
|
35.9
|
1.0
|
O
|
A:ASP49
|
4.2
|
53.4
|
1.0
|
O
|
A:HOH310
|
4.2
|
63.1
|
1.0
|
O5'
|
A:DGT201
|
4.2
|
37.6
|
1.0
|
CB
|
A:ASP49
|
4.3
|
50.2
|
1.0
|
CB
|
A:ASP51
|
4.4
|
46.1
|
1.0
|
C
|
A:ASP49
|
4.4
|
50.2
|
1.0
|
O1A
|
A:DGT201
|
4.5
|
36.6
|
1.0
|
N
|
A:ASP49
|
4.5
|
50.5
|
1.0
|
N
|
A:SER39
|
4.5
|
44.5
|
1.0
|
O1B
|
A:DGT201
|
4.5
|
39.6
|
1.0
|
O1G
|
A:DGT201
|
4.6
|
40.7
|
1.0
|
OD2
|
A:ASP100
|
4.6
|
52.0
|
1.0
|
CA
|
A:ASP49
|
4.7
|
49.8
|
1.0
|
CA
|
A:GLY38
|
4.9
|
44.0
|
1.0
|
CB
|
A:SER39
|
4.9
|
44.0
|
1.0
|
|
Manganese binding site 2 out
of 4 in 5hri
Go back to
Manganese Binding Sites List in 5hri
Manganese binding site 2 out
of 4 in the The Crystal Structure of Asfvpolx:DNA1 Binary Complex
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 2 of The Crystal Structure of Asfvpolx:DNA1 Binary Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mn203
b:50.7
occ:0.20
|
OD1
|
A:ASP51
|
2.0
|
49.9
|
1.0
|
OD2
|
A:ASP100
|
2.0
|
52.0
|
1.0
|
O2A
|
A:DGT201
|
2.1
|
44.8
|
1.0
|
CG
|
A:ASP51
|
2.8
|
46.4
|
1.0
|
OD2
|
A:ASP51
|
2.9
|
47.2
|
1.0
|
OD1
|
A:ASP49
|
3.0
|
51.5
|
1.0
|
OD2
|
A:ASP49
|
3.1
|
58.3
|
1.0
|
MN
|
A:MN202
|
3.1
|
58.6
|
1.0
|
CG
|
A:ASP100
|
3.2
|
50.2
|
1.0
|
CG
|
A:ASP49
|
3.3
|
53.0
|
1.0
|
PA
|
A:DGT201
|
3.3
|
37.4
|
1.0
|
C5'
|
A:DGT201
|
3.7
|
35.9
|
1.0
|
O5'
|
A:DGT201
|
3.8
|
37.6
|
1.0
|
C3'
|
D:DA9
|
3.8
|
51.8
|
1.0
|
C5'
|
D:DA9
|
3.8
|
48.1
|
1.0
|
CB
|
A:ASP100
|
3.8
|
52.6
|
1.0
|
C4'
|
D:DA9
|
4.0
|
50.9
|
1.0
|
O
|
A:HOH309
|
4.0
|
66.0
|
1.0
|
O1A
|
A:DGT201
|
4.2
|
36.6
|
1.0
|
OD1
|
A:ASP100
|
4.2
|
55.6
|
1.0
|
CB
|
A:ASP51
|
4.3
|
46.1
|
1.0
|
O2G
|
A:DGT201
|
4.5
|
53.8
|
1.0
|
CZ
|
A:PHE102
|
4.5
|
46.4
|
1.0
|
O2B
|
A:DGT201
|
4.5
|
53.0
|
1.0
|
O5'
|
D:DA9
|
4.6
|
54.5
|
1.0
|
CB
|
A:ASP49
|
4.6
|
50.2
|
1.0
|
O3A
|
A:DGT201
|
4.7
|
40.4
|
1.0
|
CE2
|
A:PHE102
|
4.8
|
46.9
|
1.0
|
O
|
A:HOH301
|
4.9
|
53.8
|
1.0
|
CA
|
A:ASP51
|
5.0
|
47.7
|
1.0
|
|
Manganese binding site 3 out
of 4 in 5hri
Go back to
Manganese Binding Sites List in 5hri
Manganese binding site 3 out
of 4 in the The Crystal Structure of Asfvpolx:DNA1 Binary Complex
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 3 of The Crystal Structure of Asfvpolx:DNA1 Binary Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mn202
b:60.3
occ:1.00
|
O1B
|
B:DGT201
|
2.0
|
55.8
|
1.0
|
OD2
|
B:ASP51
|
2.0
|
47.6
|
1.0
|
OD1
|
B:ASP49
|
2.0
|
53.9
|
1.0
|
O1G
|
B:DGT201
|
2.0
|
51.4
|
1.0
|
O1A
|
B:DGT201
|
2.1
|
44.0
|
1.0
|
O
|
B:HOH304
|
2.2
|
53.4
|
1.0
|
MN
|
B:MN203
|
2.9
|
45.9
|
0.2
|
CG
|
B:ASP49
|
2.9
|
53.3
|
1.0
|
PB
|
B:DGT201
|
3.1
|
46.6
|
1.0
|
CG
|
B:ASP51
|
3.1
|
42.6
|
1.0
|
PA
|
B:DGT201
|
3.2
|
35.3
|
1.0
|
OD2
|
B:ASP49
|
3.3
|
54.4
|
1.0
|
PG
|
B:DGT201
|
3.3
|
45.9
|
1.0
|
O3A
|
B:DGT201
|
3.4
|
37.4
|
1.0
|
O3B
|
B:DGT201
|
3.6
|
43.6
|
1.0
|
OD1
|
B:ASP51
|
3.6
|
47.8
|
1.0
|
O2G
|
B:DGT201
|
3.9
|
50.8
|
1.0
|
OG
|
B:SER39
|
3.9
|
39.3
|
1.0
|
C5'
|
B:DGT201
|
4.0
|
32.5
|
1.0
|
O
|
B:HOH328
|
4.1
|
63.7
|
1.0
|
O5'
|
B:DGT201
|
4.1
|
34.5
|
1.0
|
O
|
B:ASP49
|
4.2
|
38.5
|
1.0
|
CB
|
B:ASP49
|
4.3
|
49.5
|
1.0
|
CB
|
B:ASP51
|
4.4
|
42.7
|
1.0
|
C
|
B:ASP49
|
4.4
|
39.2
|
1.0
|
N
|
B:SER39
|
4.5
|
36.7
|
1.0
|
O3G
|
B:DGT201
|
4.5
|
49.7
|
1.0
|
O2B
|
B:DGT201
|
4.5
|
42.4
|
1.0
|
O2A
|
B:DGT201
|
4.5
|
32.1
|
1.0
|
N
|
B:ASP49
|
4.5
|
50.0
|
1.0
|
OD2
|
B:ASP100
|
4.6
|
56.0
|
1.0
|
CA
|
B:ASP49
|
4.7
|
46.8
|
1.0
|
CA
|
B:GLY38
|
4.8
|
35.2
|
1.0
|
CB
|
B:SER39
|
4.9
|
38.5
|
1.0
|
|
Manganese binding site 4 out
of 4 in 5hri
Go back to
Manganese Binding Sites List in 5hri
Manganese binding site 4 out
of 4 in the The Crystal Structure of Asfvpolx:DNA1 Binary Complex
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 4 of The Crystal Structure of Asfvpolx:DNA1 Binary Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mn203
b:45.9
occ:0.20
|
OD2
|
B:ASP100
|
2.0
|
56.0
|
1.0
|
O1A
|
B:DGT201
|
2.0
|
44.0
|
1.0
|
OD1
|
B:ASP51
|
2.0
|
47.8
|
1.0
|
CG
|
B:ASP51
|
2.8
|
42.6
|
1.0
|
OD1
|
B:ASP49
|
2.8
|
53.9
|
1.0
|
OD2
|
B:ASP51
|
2.8
|
47.6
|
1.0
|
MN
|
B:MN202
|
2.9
|
60.3
|
1.0
|
OD2
|
B:ASP49
|
3.0
|
54.4
|
1.0
|
CG
|
B:ASP49
|
3.1
|
53.3
|
1.0
|
CG
|
B:ASP100
|
3.2
|
47.8
|
1.0
|
PA
|
B:DGT201
|
3.3
|
35.3
|
1.0
|
C5'
|
B:DGT201
|
3.7
|
32.5
|
1.0
|
CB
|
B:ASP100
|
3.8
|
43.9
|
1.0
|
O5'
|
B:DGT201
|
3.8
|
34.5
|
1.0
|
C3'
|
G:DA9
|
3.9
|
44.4
|
1.0
|
C5'
|
G:DA9
|
3.9
|
47.7
|
1.0
|
C4'
|
G:DA9
|
4.1
|
47.2
|
1.0
|
OD1
|
B:ASP100
|
4.2
|
46.2
|
1.0
|
O2A
|
B:DGT201
|
4.2
|
32.1
|
1.0
|
CB
|
B:ASP51
|
4.2
|
42.7
|
1.0
|
O1G
|
B:DGT201
|
4.2
|
51.4
|
1.0
|
O1B
|
B:DGT201
|
4.4
|
55.8
|
1.0
|
CB
|
B:ASP49
|
4.4
|
49.5
|
1.0
|
O3A
|
B:DGT201
|
4.6
|
37.4
|
1.0
|
CZ
|
B:PHE102
|
4.6
|
41.0
|
1.0
|
O
|
B:HOH304
|
4.7
|
53.4
|
1.0
|
O5'
|
G:DA9
|
4.7
|
53.7
|
1.0
|
CE2
|
B:PHE102
|
4.9
|
40.1
|
1.0
|
CA
|
B:ASP51
|
4.9
|
41.4
|
1.0
|
NE2
|
B:GLN98
|
4.9
|
50.6
|
1.0
|
|
Reference:
Y.Q.Chen,
J.Zhang,
J.H.Gan.
The Crystal Structure of Asfvpolx: 1NT-Gap(P) DNA1: Dgtp Ternary Complex. To Be Published.
Page generated: Sun Oct 6 00:32:35 2024
|