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Structure of a human nucleosome at 3.2 a resolution

Analyse Structure of a human nucleosome at 3.2 a resolution in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6T79
Type
protein + DNA
Length
1,066 residues
Chains
10
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Histone H3.2; Histone H4; Histone H2A type 1-B/E; Histone H2B type 1-K; DNA (147-mer)
UniProt
Q71DI3, P62805, P04908, O60814
Pockets
20 · best druggability 0.79

Structure

electron microscopy · 8 distinct chains · 61% helix, 6% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHistone H3.2protein9863% helix, 4% strandQ71DI3
BHistone H4protein8458% helix, 8% strandP62805
C, GHistone H2A type 1-B/Eprotein11049% helix, 6% strandP04908
D, HHistone H2B type 1-Kprotein9572% helix, 4% strandO60814
EHistone H3.2protein9766% helix, 4% strandQ71DI3
FHistone H4protein8756% helix, 8% strandP62805
IDNA (147-mer)dna145——
JDNA (147-mer)dna145——

Pockets

20 pockets found on a 1 Å grid, 20 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17730.790.8379empty
26470.770.8370empty
33410.740.8651empty
42260.720.8834empty
59980.700.7573empty

Interfaces

35 interfaces between chains.

  • I–J · 6530 Ų buried · 487 hydrogen bonds · nucleic-nucleic
  • A–B · 2715 Ų buried · 25 hydrogen bonds · protein-protein
  • E–F · 2665 Ų buried · 22 hydrogen bonds · protein-protein
  • C–D · 2567 Ų buried · 16 hydrogen bonds · protein-protein
  • G–H · 2553 Ų buried · 14 hydrogen bonds · protein-protein

Compared structures

  • 6T79 · Structure of a human nucleosome at 3.2 A resolution · the same entry in another collection · chain J against J, TM-score 1.00
  • Q71DI3 · AlphaFold monomer V2.0 prediction for histone H3.2 (Q71DI3) · a predicted model of the same protein · chain E against A, TM-score 0.98

Analyse

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