Manganese in PDB 3lel: Structural Insight Into the Sequence-Dependence of Nucleosome Positioning
Protein crystallography data
The structure of Structural Insight Into the Sequence-Dependence of Nucleosome Positioning, PDB code: 3lel
was solved by
B.Wu,
D.Vasudevan,
C.A.Davey,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
60.00 /
2.95
|
Space group
|
P 1 21 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
106.747,
178.508,
110.412,
90.00,
102.78,
90.00
|
R / Rfree (%)
|
22.9 /
30
|
Manganese Binding Sites:
Pages:
>>> Page 1 <<<
Page 2, Binding sites: 11 -
20;
Page 3, Binding sites: 21 -
30;
Page 4, Binding sites: 31 -
34;
Binding sites:
The binding sites of Manganese atom in the Structural Insight Into the Sequence-Dependence of Nucleosome Positioning
(pdb code 3lel). This binding sites where shown within
5.0 Angstroms radius around Manganese atom.
In total 34 binding sites of Manganese where determined in the
Structural Insight Into the Sequence-Dependence of Nucleosome Positioning, PDB code: 3lel:
Jump to Manganese binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
9;
10;
Manganese binding site 1 out
of 34 in 3lel
Go back to
Manganese Binding Sites List in 3lel
Manganese binding site 1 out
of 34 in the Structural Insight Into the Sequence-Dependence of Nucleosome Positioning
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 1 of Structural Insight Into the Sequence-Dependence of Nucleosome Positioning within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
N:Mn3132
b:0.1
occ:1.00
|
OE1
|
N:GLU102
|
3.0
|
83.8
|
1.0
|
CD
|
N:GLU102
|
3.8
|
83.0
|
1.0
|
OD2
|
E:ASP77
|
4.0
|
78.2
|
1.0
|
OE2
|
N:GLU102
|
4.3
|
83.8
|
1.0
|
CE
|
N:LYS105
|
4.4
|
83.7
|
1.0
|
OE2
|
E:GLU73
|
4.5
|
66.1
|
1.0
|
CD
|
N:LYS105
|
4.5
|
83.5
|
1.0
|
OD1
|
E:ASP77
|
4.5
|
76.4
|
1.0
|
NZ
|
F:LYS59
|
4.6
|
63.3
|
1.0
|
CG
|
E:ASP77
|
4.7
|
76.6
|
1.0
|
CG
|
E:GLU73
|
4.9
|
65.3
|
1.0
|
CG
|
N:GLU102
|
4.9
|
80.6
|
1.0
|
|
Manganese binding site 2 out
of 34 in 3lel
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Manganese Binding Sites List in 3lel
Manganese binding site 2 out
of 34 in the Structural Insight Into the Sequence-Dependence of Nucleosome Positioning
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 2 of Structural Insight Into the Sequence-Dependence of Nucleosome Positioning within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
O:Mn3152
b:67.8
occ:1.00
|
OD1
|
O:ASP77
|
2.5
|
63.9
|
1.0
|
CG
|
O:ASP77
|
3.5
|
62.4
|
1.0
|
OD2
|
O:ASP77
|
3.7
|
63.3
|
1.0
|
O
|
P:LEU22
|
3.9
|
83.7
|
1.0
|
O
|
O:GLU73
|
4.6
|
58.9
|
1.0
|
CB
|
O:ASP77
|
4.9
|
62.1
|
1.0
|
CG
|
O:GLU73
|
5.0
|
57.9
|
1.0
|
|
Manganese binding site 3 out
of 34 in 3lel
Go back to
Manganese Binding Sites List in 3lel
Manganese binding site 3 out
of 34 in the Structural Insight Into the Sequence-Dependence of Nucleosome Positioning
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 3 of Structural Insight Into the Sequence-Dependence of Nucleosome Positioning within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
S:Mn3133
b:91.5
occ:1.00
|
C4'
|
S:DT67
|
4.3
|
75.1
|
1.0
|
O4'
|
S:DT67
|
4.3
|
73.3
|
1.0
|
C5'
|
S:DT67
|
4.4
|
77.6
|
1.0
|
O4'
|
T:DC-64
|
4.4
|
73.6
|
1.0
|
O2
|
T:DC-65
|
4.4
|
75.1
|
1.0
|
N3
|
S:DA66
|
4.5
|
74.8
|
1.0
|
C5'
|
T:DC-64
|
4.7
|
76.1
|
1.0
|
C4'
|
T:DC-64
|
4.7
|
75.2
|
1.0
|
|
Manganese binding site 4 out
of 34 in 3lel
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Manganese Binding Sites List in 3lel
Manganese binding site 4 out
of 34 in the Structural Insight Into the Sequence-Dependence of Nucleosome Positioning
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 4 of Structural Insight Into the Sequence-Dependence of Nucleosome Positioning within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
T:Mn3134
b:95.0
occ:1.00
|
N7
|
T:DG61
|
2.5
|
0.5
|
1.0
|
C8
|
T:DG61
|
3.4
|
0.8
|
1.0
|
C5
|
T:DG61
|
3.5
|
0.5
|
1.0
|
O6
|
T:DG61
|
3.6
|
0.2
|
1.0
|
C6
|
T:DG61
|
3.9
|
0.9
|
1.0
|
C8
|
T:DA60
|
4.2
|
94.0
|
1.0
|
N7
|
T:DA60
|
4.3
|
93.5
|
1.0
|
OP2
|
T:DA60
|
4.5
|
0.4
|
1.0
|
N9
|
T:DG61
|
4.6
|
0.4
|
1.0
|
O6
|
T:DG62
|
4.7
|
1.0
|
1.0
|
C4
|
T:DG61
|
4.7
|
0.6
|
1.0
|
N9
|
T:DA60
|
4.8
|
94.5
|
1.0
|
C2'
|
T:DA60
|
5.0
|
97.8
|
1.0
|
C5
|
T:DA60
|
5.0
|
93.2
|
1.0
|
|
Manganese binding site 5 out
of 34 in 3lel
Go back to
Manganese Binding Sites List in 3lel
Manganese binding site 5 out
of 34 in the Structural Insight Into the Sequence-Dependence of Nucleosome Positioning
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 5 of Structural Insight Into the Sequence-Dependence of Nucleosome Positioning within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
J:Mn3135
b:0.3
occ:1.00
|
N7
|
J:DG27
|
2.6
|
91.3
|
1.0
|
O6
|
J:DG27
|
3.3
|
91.4
|
1.0
|
C5
|
J:DG27
|
3.3
|
91.3
|
1.0
|
C8
|
J:DG27
|
3.5
|
91.3
|
1.0
|
C6
|
J:DG27
|
3.6
|
91.4
|
1.0
|
O6
|
I:DG-28
|
4.2
|
0.2
|
1.0
|
C4
|
J:DG27
|
4.4
|
91.1
|
1.0
|
N9
|
J:DG27
|
4.5
|
91.1
|
1.0
|
N1
|
J:DG27
|
4.9
|
91.1
|
1.0
|
O4
|
I:DT-29
|
4.9
|
0.5
|
1.0
|
|
Manganese binding site 6 out
of 34 in 3lel
Go back to
Manganese Binding Sites List in 3lel
Manganese binding site 6 out
of 34 in the Structural Insight Into the Sequence-Dependence of Nucleosome Positioning
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 6 of Structural Insight Into the Sequence-Dependence of Nucleosome Positioning within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
I:Mn3136
b:0.7
occ:1.00
|
N7
|
I:DG27
|
2.1
|
97.6
|
1.0
|
O6
|
I:DG27
|
2.8
|
97.5
|
1.0
|
C5
|
I:DG27
|
2.9
|
97.5
|
1.0
|
C6
|
I:DG27
|
3.2
|
97.5
|
1.0
|
C8
|
I:DG27
|
3.2
|
97.6
|
1.0
|
C8
|
I:DA26
|
4.0
|
0.0
|
1.0
|
C4
|
I:DG27
|
4.1
|
97.4
|
1.0
|
N7
|
I:DA26
|
4.2
|
0.3
|
1.0
|
N9
|
I:DG27
|
4.3
|
97.4
|
1.0
|
OP2
|
I:DA26
|
4.4
|
0.6
|
1.0
|
N1
|
I:DG27
|
4.5
|
97.3
|
1.0
|
N9
|
I:DA26
|
4.6
|
0.6
|
1.0
|
C2'
|
I:DA26
|
4.6
|
0.9
|
1.0
|
C5
|
I:DA26
|
4.9
|
0.8
|
1.0
|
|
Manganese binding site 7 out
of 34 in 3lel
Go back to
Manganese Binding Sites List in 3lel
Manganese binding site 7 out
of 34 in the Structural Insight Into the Sequence-Dependence of Nucleosome Positioning
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 7 of Structural Insight Into the Sequence-Dependence of Nucleosome Positioning within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
J:Mn3137
b:85.2
occ:1.00
|
N7
|
J:DG61
|
2.2
|
89.7
|
1.0
|
C8
|
J:DG61
|
3.2
|
89.8
|
1.0
|
C5
|
J:DG61
|
3.3
|
89.8
|
1.0
|
O6
|
J:DG61
|
3.6
|
89.7
|
1.0
|
C6
|
J:DG61
|
3.8
|
89.7
|
1.0
|
N7
|
J:DA60
|
4.0
|
80.0
|
1.0
|
C8
|
J:DA60
|
4.0
|
80.0
|
1.0
|
OP2
|
J:DA60
|
4.1
|
78.6
|
1.0
|
N9
|
J:DG61
|
4.4
|
90.2
|
1.0
|
C4
|
J:DG61
|
4.5
|
89.9
|
1.0
|
N9
|
J:DA60
|
4.7
|
80.2
|
1.0
|
C5
|
J:DA60
|
4.7
|
79.7
|
1.0
|
O6
|
J:DG62
|
4.8
|
0.1
|
1.0
|
C2'
|
J:DA60
|
4.9
|
81.5
|
1.0
|
|
Manganese binding site 8 out
of 34 in 3lel
Go back to
Manganese Binding Sites List in 3lel
Manganese binding site 8 out
of 34 in the Structural Insight Into the Sequence-Dependence of Nucleosome Positioning
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 8 of Structural Insight Into the Sequence-Dependence of Nucleosome Positioning within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
J:Mn3138
b:0.8
occ:1.00
|
N7
|
J:DG48
|
2.3
|
97.6
|
1.0
|
C5
|
J:DG48
|
3.2
|
97.6
|
1.0
|
O6
|
J:DG48
|
3.2
|
97.5
|
1.0
|
C8
|
J:DG48
|
3.3
|
97.5
|
1.0
|
C6
|
J:DG48
|
3.6
|
97.8
|
1.0
|
O6
|
J:DG49
|
3.9
|
99.6
|
1.0
|
C2'
|
J:DT47
|
4.3
|
0.9
|
1.0
|
OP2
|
J:DG48
|
4.4
|
97.4
|
1.0
|
C4
|
J:DG48
|
4.4
|
97.5
|
1.0
|
N9
|
J:DG48
|
4.5
|
97.2
|
1.0
|
N7
|
J:DG49
|
4.7
|
0.2
|
1.0
|
C6
|
J:DG49
|
4.8
|
99.8
|
1.0
|
N1
|
J:DG48
|
4.9
|
97.6
|
1.0
|
|
Manganese binding site 9 out
of 34 in 3lel
Go back to
Manganese Binding Sites List in 3lel
Manganese binding site 9 out
of 34 in the Structural Insight Into the Sequence-Dependence of Nucleosome Positioning
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 9 of Structural Insight Into the Sequence-Dependence of Nucleosome Positioning within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
T:Mn3139
b:0.7
occ:1.00
|
N7
|
T:DG64
|
2.5
|
0.1
|
1.0
|
C8
|
T:DG64
|
2.7
|
0.1
|
1.0
|
C5
|
T:DG64
|
3.9
|
0.9
|
1.0
|
OP2
|
T:DG64
|
4.0
|
0.8
|
1.0
|
N7
|
T:DG65
|
4.0
|
0.2
|
1.0
|
N9
|
T:DG64
|
4.1
|
0.1
|
1.0
|
O6
|
T:DG65
|
4.1
|
0.3
|
1.0
|
C6
|
T:DT63
|
4.3
|
0.1
|
1.0
|
C2'
|
T:DT63
|
4.3
|
0.5
|
1.0
|
C5
|
T:DT63
|
4.5
|
0.0
|
1.0
|
N1
|
T:DT63
|
4.6
|
0.2
|
1.0
|
C4
|
T:DG64
|
4.6
|
0.1
|
1.0
|
C5
|
T:DG65
|
4.6
|
0.2
|
1.0
|
C6
|
T:DG65
|
4.7
|
1.0
|
1.0
|
C6
|
T:DG64
|
4.8
|
0.5
|
1.0
|
C2'
|
T:DG64
|
4.9
|
0.7
|
1.0
|
C7
|
T:DT63
|
4.9
|
0.1
|
1.0
|
O5'
|
T:DG64
|
4.9
|
0.5
|
1.0
|
O6
|
T:DG64
|
4.9
|
0.3
|
1.0
|
C1'
|
T:DT63
|
5.0
|
0.6
|
1.0
|
C4
|
T:DT63
|
5.0
|
0.1
|
1.0
|
C8
|
T:DG65
|
5.0
|
0.2
|
1.0
|
|
Manganese binding site 10 out
of 34 in 3lel
Go back to
Manganese Binding Sites List in 3lel
Manganese binding site 10 out
of 34 in the Structural Insight Into the Sequence-Dependence of Nucleosome Positioning
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 10 of Structural Insight Into the Sequence-Dependence of Nucleosome Positioning within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
G:Mn3140
b:0.6
occ:1.00
|
OE1
|
G:GLU91
|
2.9
|
82.4
|
1.0
|
CD
|
G:GLU91
|
4.1
|
81.3
|
1.0
|
O
|
N:VAL45
|
4.3
|
91.3
|
1.0
|
OE2
|
M:GLU64
|
4.5
|
87.1
|
1.0
|
OE1
|
M:GLU64
|
4.7
|
86.4
|
1.0
|
OE2
|
G:GLU91
|
4.9
|
82.6
|
1.0
|
|
Reference:
B.Wu,
K.Mohideen,
D.Vasudevan,
C.A.Davey.
Structural Insight Into the Sequence Dependence of Nucleosome Positioning Structure V. 18 528 2010.
ISSN: ISSN 0969-2126
PubMed: 20399189
DOI: 10.1016/J.STR.2010.01.015
Page generated: Sat Oct 5 16:48:45 2024
|