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Manganese in PDB 5y0c: Crystal Structure of the Human Nucleosome at 2.09 Angstrom Resolution

Protein crystallography data

The structure of Crystal Structure of the Human Nucleosome at 2.09 Angstrom Resolution, PDB code: 5y0c was solved by H.Kurumizaka, Y.Arimura, R.Fujita, M.Noda, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 20.00 / 2.09
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 98.913, 107.103, 167.003, 90.00, 90.00, 90.00
R / Rfree (%) 20.2 / 24.9

Other elements in 5y0c:

The structure of Crystal Structure of the Human Nucleosome at 2.09 Angstrom Resolution also contains other interesting chemical elements:

Chlorine (Cl) 4 atoms

Manganese Binding Sites:

The binding sites of Manganese atom in the Crystal Structure of the Human Nucleosome at 2.09 Angstrom Resolution (pdb code 5y0c). This binding sites where shown within 5.0 Angstroms radius around Manganese atom.
In total 10 binding sites of Manganese where determined in the Crystal Structure of the Human Nucleosome at 2.09 Angstrom Resolution, PDB code: 5y0c:
Jump to Manganese binding site number: 1; 2; 3; 4; 5; 6; 7; 8; 9; 10;

Manganese binding site 1 out of 10 in 5y0c

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Manganese binding site 1 out of 10 in the Crystal Structure of the Human Nucleosome at 2.09 Angstrom Resolution


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Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 1 of Crystal Structure of the Human Nucleosome at 2.09 Angstrom Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
I:Mn201

b:33.4
occ:1.00
OP2 I:DA27 1.9 35.6 1.0
O I:HOH347 2.1 27.9 1.0
O I:HOH346 2.2 32.6 1.0
O I:HOH349 2.2 29.4 1.0
P I:DA27 3.4 34.3 1.0
O3' I:DC26 4.0 32.6 1.0
N7 I:DA27 4.2 31.6 1.0
C8 I:DA27 4.2 33.8 1.0
OP1 I:DA27 4.2 33.0 1.0
O5' I:DA27 4.4 30.4 1.0
C3' I:DC26 4.4 34.3 1.0
C2' I:DC26 4.9 33.2 1.0

Manganese binding site 2 out of 10 in 5y0c

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Manganese binding site 2 out of 10 in the Crystal Structure of the Human Nucleosome at 2.09 Angstrom Resolution


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Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 2 of Crystal Structure of the Human Nucleosome at 2.09 Angstrom Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
I:Mn202

b:63.4
occ:1.00
N7 I:DG134 2.4 44.9 1.0
C8 I:DG134 3.3 45.7 1.0
C5 I:DG134 3.5 42.4 1.0
O6 I:DG134 3.8 47.1 1.0
C6 I:DG134 4.1 43.7 1.0
O6 I:DG135 4.1 50.1 1.0
N7 I:DA133 4.2 43.0 1.0
C8 I:DA133 4.2 49.2 1.0
N9 I:DG134 4.5 48.3 1.0
C4 I:DG134 4.6 45.7 1.0
N7 I:DG135 4.8 47.6 1.0

Manganese binding site 3 out of 10 in 5y0c

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Manganese binding site 3 out of 10 in the Crystal Structure of the Human Nucleosome at 2.09 Angstrom Resolution


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 the Human Nucleosome at 2.09 Angstrom Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
I:Mn203

b:54.8
occ:1.00
O6 I:DG68 2.2 45.6 1.0
C6 I:DG68 3.3 44.3 1.0
N4 J:DC225 3.9 42.0 1.0
O6 J:DG224 3.9 45.5 1.0
C5 I:DG68 4.0 41.1 1.0
N7 I:DG68 4.0 39.5 1.0
N7 J:DG224 4.1 49.9 1.0
N1 I:DG68 4.4 42.3 1.0
N7 I:DA67 4.6 41.5 1.0
C6 J:DG224 4.7 40.9 1.0
C5 J:DG224 4.7 45.6 1.0

Manganese binding site 4 out of 10 in 5y0c

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Manganese binding site 4 out of 10 in the Crystal Structure of the Human Nucleosome at 2.09 Angstrom Resolution


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 the Human Nucleosome at 2.09 Angstrom Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
I:Mn204

b:42.4
occ:1.00
O J:HOH3171 2.1 39.8 1.0
O I:HOH368 2.3 39.4 1.0
O J:HOH3121 2.3 33.5 1.0
O I:HOH308 2.5 38.8 1.0
N3 I:DA113 4.3 30.6 1.0
C5' I:DC114 4.3 43.1 1.0
O4' I:DC114 4.3 39.1 1.0
C4' I:DC114 4.5 43.5 1.0
N3 J:DA181 4.7 32.7 1.0
C5' J:DT182 4.7 37.5 1.0
C4' J:DT182 4.7 35.6 1.0
O4' J:DT182 4.8 35.0 1.0
C2 I:DA113 4.9 32.8 1.0
C1' I:DA113 5.0 36.9 1.0

Manganese binding site 5 out of 10 in 5y0c

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Manganese binding site 5 out of 10 in the Crystal Structure of the Human Nucleosome at 2.09 Angstrom Resolution


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 the Human Nucleosome at 2.09 Angstrom Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
I:Mn205

b:41.3
occ:1.00
O I:HOH362 2.1 39.0 1.0
O I:HOH367 2.2 38.0 1.0
O I:HOH304 2.2 34.5 1.0
N7 I:DG121 2.3 31.4 1.0
O I:HOH310 2.5 38.0 1.0
C8 I:DG121 3.3 31.3 1.0
C5 I:DG121 3.3 29.3 1.0
O6 I:DG121 3.6 32.4 1.0
C6 I:DG121 3.8 31.5 1.0
C2' I:DT120 4.2 36.7 1.0
O J:HOH3143 4.4 36.1 1.0
N9 I:DG121 4.5 30.4 1.0
C4 I:DG121 4.5 29.5 1.0
O6 I:DG122 4.6 29.8 1.0
C6 I:DT120 4.7 27.9 1.0
N4 J:DC171 5.0 28.9 1.0

Manganese binding site 6 out of 10 in 5y0c

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Manganese binding site 6 out of 10 in the Crystal Structure of the Human Nucleosome at 2.09 Angstrom Resolution


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 the Human Nucleosome at 2.09 Angstrom Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
J:Mn3001

b:65.2
occ:1.00
N7 J:DG280 2.2 52.9 1.0
C8 J:DG280 3.1 56.6 1.0
C5 J:DG280 3.3 52.2 1.0
O6 J:DG280 3.7 49.0 1.0
C8 J:DA279 3.9 47.9 1.0
C6 J:DG280 3.9 50.8 1.0
N7 J:DA279 4.1 47.2 1.0
O6 J:DG281 4.3 53.2 1.0
N9 J:DG280 4.3 57.5 1.0
C4 J:DG280 4.5 52.2 1.0
OP2 J:DA279 4.5 48.1 1.0
N9 J:DA279 4.8 49.4 1.0
C2' J:DA279 4.8 55.9 1.0

Manganese binding site 7 out of 10 in 5y0c

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Manganese binding site 7 out of 10 in the Crystal Structure of the Human Nucleosome at 2.09 Angstrom Resolution


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 the Human Nucleosome at 2.09 Angstrom Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
J:Mn3002

b:41.3
occ:1.00
O J:HOH3130 1.8 34.9 1.0
O J:HOH3101 2.1 35.0 1.0
O J:HOH3109 2.1 37.4 1.0
O J:HOH3177 2.3 37.5 1.0
N7 J:DG267 2.4 38.6 1.0
O J:HOH3169 2.6 41.8 1.0
C8 J:DG267 3.2 37.3 1.0
C5 J:DG267 3.4 34.3 1.0
O6 J:DG267 3.7 34.4 1.0
C6 J:DG267 4.0 34.3 1.0
OP2 J:DG267 4.1 41.4 1.0
O6 J:DG268 4.2 30.6 1.0
O J:HOH3146 4.3 34.3 1.0
N9 J:DG267 4.5 34.8 1.0
C2' J:DT266 4.5 40.9 1.0
C4 J:DG267 4.5 32.7 1.0
N4 I:DC25 5.0 30.4 1.0

Manganese binding site 8 out of 10 in 5y0c

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Manganese binding site 8 out of 10 in the Crystal Structure of the Human Nucleosome at 2.09 Angstrom Resolution


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 the Human Nucleosome at 2.09 Angstrom Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
J:Mn3003

b:50.8
occ:1.00
O J:HOH3157 2.1 36.7 1.0
N7 J:DG185 2.3 39.2 1.0
O6 J:DG186 2.5 33.0 1.0
C8 J:DG185 3.1 35.5 1.0
C5 J:DG185 3.2 35.5 1.0
C6 J:DG186 3.3 36.0 1.0
O6 J:DG185 3.6 38.1 1.0
C6 J:DG185 3.7 37.3 1.0
N7 J:DG186 3.9 34.5 1.0
C5 J:DG186 3.9 35.3 1.0
N4 I:DC107 4.0 38.6 1.0
OP2 J:DG185 4.2 46.5 1.0
N9 J:DG185 4.3 34.8 1.0
C4 J:DG185 4.3 33.2 1.0
N1 J:DG186 4.4 33.4 1.0
C2' J:DT184 4.7 38.7 1.0

Manganese binding site 9 out of 10 in 5y0c

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Manganese binding site 9 out of 10 in the Crystal Structure of the Human Nucleosome at 2.09 Angstrom Resolution


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 the Human Nucleosome at 2.09 Angstrom Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
J:Mn3004

b:52.6
occ:1.00
N7 J:DG217 2.1 35.4 1.0
C8 J:DG217 2.9 32.4 1.0
C5 J:DG217 3.3 34.5 1.0
O6 J:DG217 3.9 36.4 1.0
C6 J:DG217 4.0 33.7 1.0
C2' J:DT216 4.0 30.6 1.0
N6 J:DA218 4.0 37.5 1.0
N9 J:DG217 4.2 35.9 1.0
OP2 J:DG217 4.3 26.9 1.0
C4 J:DG217 4.4 33.1 1.0
C6 J:DT216 4.6 30.8 1.0
N7 J:DA218 4.7 37.2 1.0
C6 J:DA218 4.8 36.8 1.0
N1 J:DT216 5.0 33.3 1.0

Manganese binding site 10 out of 10 in 5y0c

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Manganese binding site 10 out of 10 in the Crystal Structure of the Human Nucleosome at 2.09 Angstrom Resolution


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 10 of Crystal Structure of the Human Nucleosome at 2.09 Angstrom Resolution within 5.0Å range:
probe atom residue distance (Å) B Occ
E:Mn201

b:27.1
occ:1.00
O E:HOH315 2.0 26.8 1.0
O E:HOH328 2.0 26.2 1.0
OD1 E:ASP77 2.1 30.3 1.0
CG E:ASP77 3.1 28.8 1.0
OD2 E:ASP77 3.4 32.4 1.0
CB E:ASP77 4.4 30.2 1.0
O E:GLU73 4.4 26.9 1.0
N E:ASP77 4.7 30.9 1.0
CA E:ASP77 4.7 30.6 1.0
O F:LEU22 4.9 25.0 1.0
CG E:GLU73 4.9 22.4 1.0

Reference:

Y.Arimura, M.Ikura, R.Fujita, M.Noda, W.Kobayashi, N.Horikoshi, J.Sun, L.Shi, M.Kusakabe, M.Harata, Y.Ohkawa, S.Tashiro, H.Kimura, T.Ikura, H.Kurumizaka. Cancer-Associated Mutations of Histones H2B, H3.1 and H2A.Z.1 Affect the Structure and Stability of the Nucleosome. Nucleic Acids Res. V. 46 10007 2018.
ISSN: ESSN 1362-4962
PubMed: 30053102
DOI: 10.1093/NAR/GKY661
Page generated: Sun Oct 6 03:30:29 2024

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