Manganese in PDB 2cv5: Crystal Structure of Human Nucleosome Core Particle
Protein crystallography data
The structure of Crystal Structure of Human Nucleosome Core Particle, PDB code: 2cv5
was solved by
Y.Tsunaka,
N.Kajimura,
S.Tate,
K.Morikawa,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
50.00 /
2.50
|
Space group
|
P 21 21 21
|
Cell size a, b, c (Å), α, β, γ (°)
|
99.564,
108.370,
169.425,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
22.4 /
27.7
|
Other elements in 2cv5:
The structure of Crystal Structure of Human Nucleosome Core Particle also contains other interesting chemical elements:
Manganese Binding Sites:
The binding sites of Manganese atom in the Crystal Structure of Human Nucleosome Core Particle
(pdb code 2cv5). This binding sites where shown within
5.0 Angstroms radius around Manganese atom.
In total 9 binding sites of Manganese where determined in the
Crystal Structure of Human Nucleosome Core Particle, PDB code: 2cv5:
Jump to Manganese binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
9;
Manganese binding site 1 out
of 9 in 2cv5
Go back to
Manganese Binding Sites List in 2cv5
Manganese binding site 1 out
of 9 in the Crystal Structure of Human Nucleosome Core Particle
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 1 of Crystal Structure of Human Nucleosome Core Particle within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
I:Mn1004
b:57.1
occ:1.00
|
O6
|
I:DG68
|
2.4
|
44.4
|
1.0
|
O
|
I:HOH1039
|
2.6
|
43.1
|
1.0
|
C6
|
I:DG68
|
3.4
|
42.0
|
1.0
|
N4
|
J:DC225
|
3.8
|
51.6
|
1.0
|
N7
|
I:DG68
|
3.9
|
42.5
|
1.0
|
C5
|
I:DG68
|
4.0
|
42.0
|
1.0
|
O6
|
J:DG224
|
4.3
|
55.3
|
1.0
|
N1
|
I:DG68
|
4.6
|
40.5
|
1.0
|
N7
|
J:DG224
|
4.6
|
58.5
|
1.0
|
N7
|
I:DA67
|
4.8
|
42.1
|
1.0
|
|
Manganese binding site 2 out
of 9 in 2cv5
Go back to
Manganese Binding Sites List in 2cv5
Manganese binding site 2 out
of 9 in the Crystal Structure of Human Nucleosome Core Particle
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 2 of Crystal Structure of Human Nucleosome Core Particle within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
I:Mn1005
b:60.6
occ:1.00
|
N7
|
I:DG121
|
2.5
|
31.4
|
1.0
|
C8
|
I:DG121
|
3.4
|
32.8
|
1.0
|
C5
|
I:DG121
|
3.6
|
32.3
|
1.0
|
O6
|
I:DG121
|
3.9
|
31.1
|
1.0
|
C6
|
I:DG121
|
4.1
|
30.3
|
1.0
|
O6
|
I:DG122
|
4.4
|
35.0
|
1.0
|
N9
|
I:DG121
|
4.6
|
33.5
|
1.0
|
C4
|
I:DG121
|
4.7
|
31.8
|
1.0
|
C2'
|
I:DT120
|
4.8
|
44.7
|
1.0
|
N4
|
J:DC171
|
5.0
|
39.0
|
1.0
|
|
Manganese binding site 3 out
of 9 in 2cv5
Go back to
Manganese Binding Sites List in 2cv5
Manganese binding site 3 out
of 9 in the Crystal Structure of Human Nucleosome Core Particle
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 3 of Crystal Structure of Human Nucleosome Core Particle within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
I:Mn1007
b:72.6
occ:1.00
|
O
|
I:HOH1042
|
2.7
|
42.5
|
1.0
|
N7
|
I:DG134
|
2.9
|
57.7
|
1.0
|
O
|
I:HOH1034
|
3.6
|
36.2
|
1.0
|
C8
|
I:DG134
|
3.8
|
59.0
|
1.0
|
C5
|
I:DG134
|
3.9
|
58.2
|
1.0
|
O6
|
I:DG134
|
4.0
|
55.5
|
1.0
|
C6
|
I:DG134
|
4.3
|
58.4
|
1.0
|
O6
|
I:DG135
|
4.3
|
67.7
|
1.0
|
C8
|
I:DA133
|
4.4
|
51.1
|
1.0
|
N7
|
I:DA133
|
4.5
|
50.2
|
1.0
|
N9
|
I:DG134
|
5.0
|
60.6
|
1.0
|
|
Manganese binding site 4 out
of 9 in 2cv5
Go back to
Manganese Binding Sites List in 2cv5
Manganese binding site 4 out
of 9 in the Crystal Structure of Human Nucleosome Core Particle
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 4 of Crystal Structure of Human Nucleosome Core Particle within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
J:Mn1001
b:49.2
occ:1.00
|
O
|
J:HOH1046
|
2.4
|
33.2
|
1.0
|
N7
|
J:DG185
|
2.5
|
31.9
|
1.0
|
O
|
J:HOH1043
|
2.6
|
43.2
|
1.0
|
O6
|
J:DG186
|
3.0
|
33.1
|
1.0
|
C8
|
J:DG185
|
3.2
|
31.7
|
1.0
|
C5
|
J:DG185
|
3.7
|
32.4
|
1.0
|
OP2
|
J:DG185
|
3.8
|
41.5
|
1.0
|
C6
|
J:DG186
|
3.9
|
32.8
|
1.0
|
O6
|
J:DG185
|
4.2
|
35.2
|
1.0
|
C2'
|
J:DT184
|
4.2
|
38.3
|
1.0
|
N7
|
J:DG186
|
4.3
|
34.1
|
1.0
|
C6
|
J:DG185
|
4.3
|
33.4
|
1.0
|
N4
|
I:DC107
|
4.4
|
48.4
|
1.0
|
C5
|
J:DG186
|
4.4
|
32.9
|
1.0
|
O3'
|
J:DT184
|
4.5
|
41.0
|
1.0
|
N9
|
J:DG185
|
4.5
|
31.9
|
1.0
|
C4
|
J:DG185
|
4.7
|
30.4
|
1.0
|
C3'
|
J:DT184
|
4.7
|
38.3
|
1.0
|
P
|
J:DG185
|
4.8
|
41.8
|
1.0
|
N1
|
J:DG186
|
4.9
|
31.3
|
1.0
|
|
Manganese binding site 5 out
of 9 in 2cv5
Go back to
Manganese Binding Sites List in 2cv5
Manganese binding site 5 out
of 9 in the Crystal Structure of Human Nucleosome Core Particle
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 5 of Crystal Structure of Human Nucleosome Core Particle within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
J:Mn1002
b:48.9
occ:1.00
|
O
|
J:HOH1044
|
2.2
|
31.7
|
1.0
|
N7
|
J:DG267
|
2.2
|
43.6
|
1.0
|
O
|
J:HOH1041
|
2.4
|
31.9
|
1.0
|
O
|
J:HOH1071
|
2.4
|
40.4
|
1.0
|
C8
|
J:DG267
|
3.2
|
43.2
|
1.0
|
C5
|
J:DG267
|
3.3
|
43.6
|
1.0
|
O6
|
J:DG267
|
3.6
|
43.5
|
1.0
|
C6
|
J:DG267
|
3.8
|
44.8
|
1.0
|
O6
|
J:DG268
|
3.9
|
39.5
|
1.0
|
OP2
|
J:DG267
|
4.0
|
49.4
|
1.0
|
C2'
|
J:DT266
|
4.2
|
51.9
|
1.0
|
N9
|
J:DG267
|
4.4
|
43.8
|
1.0
|
C4
|
J:DG267
|
4.4
|
44.3
|
1.0
|
N4
|
I:DC25
|
4.7
|
66.2
|
1.0
|
C3'
|
J:DT266
|
4.7
|
51.5
|
1.0
|
O
|
J:HOH1054
|
4.8
|
35.2
|
1.0
|
C6
|
J:DG268
|
4.9
|
40.1
|
1.0
|
|
Manganese binding site 6 out
of 9 in 2cv5
Go back to
Manganese Binding Sites List in 2cv5
Manganese binding site 6 out
of 9 in the Crystal Structure of Human Nucleosome Core Particle
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 6 of Crystal Structure of Human Nucleosome Core Particle within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
J:Mn1003
b:57.3
occ:1.00
|
N7
|
J:DG217
|
2.6
|
31.3
|
1.0
|
O
|
J:HOH1042
|
3.0
|
47.9
|
1.0
|
C8
|
J:DG217
|
3.5
|
31.4
|
1.0
|
O
|
E:HOH2028
|
3.5
|
40.2
|
1.0
|
C5
|
J:DG217
|
3.7
|
32.1
|
1.0
|
O6
|
J:DG217
|
3.9
|
30.1
|
1.0
|
O
|
I:HOH1074
|
4.0
|
32.1
|
1.0
|
C6
|
J:DG217
|
4.1
|
31.9
|
1.0
|
N6
|
J:DA218
|
4.2
|
34.8
|
1.0
|
OP2
|
J:DG217
|
4.3
|
30.9
|
1.0
|
C2'
|
J:DT216
|
4.3
|
35.6
|
1.0
|
O
|
J:HOH1052
|
4.4
|
33.4
|
1.0
|
N9
|
J:DG217
|
4.7
|
32.2
|
1.0
|
C4
|
J:DG217
|
4.8
|
32.1
|
1.0
|
C6
|
J:DT216
|
4.8
|
39.5
|
1.0
|
|
Manganese binding site 7 out
of 9 in 2cv5
Go back to
Manganese Binding Sites List in 2cv5
Manganese binding site 7 out
of 9 in the Crystal Structure of Human Nucleosome Core Particle
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 7 of Crystal Structure of Human Nucleosome Core Particle within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
J:Mn1006
b:69.6
occ:1.00
|
N7
|
J:DG280
|
2.7
|
70.5
|
1.0
|
O6
|
J:DG280
|
3.6
|
70.9
|
1.0
|
C5
|
J:DG280
|
3.7
|
71.2
|
1.0
|
C8
|
J:DG280
|
3.7
|
72.0
|
1.0
|
C8
|
J:DA279
|
4.0
|
69.9
|
1.0
|
N7
|
J:DA279
|
4.0
|
69.4
|
1.0
|
C6
|
J:DG280
|
4.0
|
70.7
|
1.0
|
O6
|
J:DG281
|
4.1
|
91.9
|
1.0
|
N7
|
J:DG281
|
4.8
|
92.0
|
1.0
|
OP2
|
J:DA279
|
4.8
|
62.1
|
1.0
|
C4
|
J:DG280
|
4.9
|
71.7
|
1.0
|
N9
|
J:DG280
|
4.9
|
73.0
|
1.0
|
|
Manganese binding site 8 out
of 9 in 2cv5
Go back to
Manganese Binding Sites List in 2cv5
Manganese binding site 8 out
of 9 in the Crystal Structure of Human Nucleosome Core Particle
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 8 of Crystal Structure of Human Nucleosome Core Particle within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
J:Mn1009
b:50.5
occ:1.00
|
O
|
J:HOH1088
|
2.2
|
39.0
|
1.0
|
O
|
I:HOH1095
|
2.8
|
41.6
|
1.0
|
O
|
J:HOH1087
|
2.8
|
57.5
|
1.0
|
O4'
|
J:DT182
|
4.4
|
45.5
|
1.0
|
N3
|
I:DA113
|
4.5
|
31.8
|
1.0
|
O
|
J:HOH1086
|
4.5
|
32.6
|
1.0
|
N3
|
J:DA181
|
4.6
|
36.9
|
1.0
|
C4'
|
J:DT182
|
4.6
|
44.8
|
1.0
|
|
Manganese binding site 9 out
of 9 in 2cv5
Go back to
Manganese Binding Sites List in 2cv5
Manganese binding site 9 out
of 9 in the Crystal Structure of Human Nucleosome Core Particle
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 9 of Crystal Structure of Human Nucleosome Core Particle within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Mn1008
b:28.7
occ:1.00
|
O
|
D:HOH1026
|
2.3
|
20.2
|
1.0
|
O
|
D:VAL45
|
2.4
|
24.2
|
1.0
|
C
|
D:VAL45
|
3.2
|
22.6
|
1.0
|
CA
|
D:VAL45
|
3.7
|
22.8
|
1.0
|
OE1
|
C:GLU64
|
3.8
|
36.9
|
1.0
|
O
|
D:GLN44
|
4.3
|
26.7
|
1.0
|
N
|
D:HIS46
|
4.3
|
23.8
|
1.0
|
O
|
C:HOH2011
|
4.4
|
18.9
|
1.0
|
CB
|
D:VAL45
|
4.4
|
23.4
|
1.0
|
CD
|
C:GLU64
|
4.6
|
36.6
|
1.0
|
OE2
|
C:GLU64
|
4.7
|
40.2
|
1.0
|
CD2
|
D:HIS46
|
4.8
|
26.5
|
1.0
|
CA
|
D:HIS46
|
4.8
|
25.3
|
1.0
|
N
|
D:VAL45
|
4.8
|
23.9
|
1.0
|
NE2
|
D:HIS46
|
4.9
|
26.1
|
1.0
|
CD
|
D:PRO47
|
5.0
|
24.8
|
1.0
|
|
Reference:
Y.Tsunaka,
N.Kajimura,
S.Tate,
K.Morikawa.
Alteration of the Nucleosomal Dna Path in the Crystal Structure of A Human Nucleosome Core Particle Nucleic Acids Res. V. 33 3424 2005.
ISSN: ISSN 0305-1048
PubMed: 15951514
DOI: 10.1093/NAR/GKI663
Page generated: Sat Oct 5 13:39:41 2024
|