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Structure of LSD2/NPAC-LINKER/NUCLEOSOME core particle complex: class 1, free nuclesome

Analyse Structure of LSD2/NPAC-LINKER/NUCLEOSOME core particle complex: class 1, free… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6R1T
Type
protein + DNA
Length
1,073 residues
Chains
10
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Histone H3; Histone H2A; Histone H2B; DNA (147-mer)
UniProt
A0A310TTQ1, Q6AZJ8, A0A1L8FQ56
Pockets
20 · best druggability 0.77

Structure

electron microscopy · 10 distinct chains · 59% helix, 5% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHistone H3protein9966% helix, 3% strandA0A310TTQ1
BHistone H2Aprotein8653% helix, 7% strand—
CHistone H2Aprotein10846% helix, 5% strandQ6AZJ8
DHistone H2Bprotein9669% helix, 3% strandA0A1L8FQ56
EHistone H3protein9862% helix, 4% strandA0A310TTQ1
FHistone H2Aprotein8657% helix, 7% strand—
GHistone H2Aprotein11148% helix, 6% strandQ6AZJ8
HHistone H2Bprotein9572% helix, 4% strandA0A1L8FQ56
IDNA (147-mer)dna147——
JDNA (147-mer)dna147——

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15940.770.8358empty
24560.750.8445empty
34050.740.8545empty
48210.720.7852empty
54070.710.8336empty

Interfaces

36 interfaces between chains.

  • I–J · 6641 Ų buried · 584 hydrogen bonds · nucleic-nucleic
  • G–H · 2602 Ų buried · 17 hydrogen bonds · protein-protein
  • E–F · 2504 Ų buried · 14 hydrogen bonds · protein-protein
  • C–D · 2477 Ų buried · 16 hydrogen bonds · protein-protein
  • A–B · 2440 Ų buried · 17 hydrogen bonds · protein-protein

Compared structures

  • 6R1T · Structure of LSD2/NPAC-linker/nucleosome core particle complex: Class 1, free nuclesome · the same entry in another collection · chain A against A, TM-score 1.00

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