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MolNFT v1 · #179449 · protein + DNA

Cryo-EM structure of a chromatosome containing human linker histone H1.4

7K5Y · Histone H3.1: “Cryo-EM structure of a chromatosome containing human linker histone H1.4”. Electron microscopy, 20 pockets (best druggability 0.79). MolNFT v1 #179449 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7K5Y
Type
protein + DNA
Length
1,691 residues
Chains
13
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Histone H3.1; Histone H4; Histone H2A type 1-B/E; Histone H2B type 1-J; DNA (197-mer)…
UniProt
P68431, P62805, P04908, P06899, P10412
Pockets
20 · best druggability 0.79

Structure

electron microscopy · 8 distinct chains · 43% helix, 22% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, EHistone H3.1protein9766% helix, 4% strandP68431
B, FHistone H4protein8360% helix, 7% strandP62805
C, GHistone H2A type 1-B/Eprotein10955% helix, 6% strandP04908
D, HHistone H2B type 1-Jprotein9573% helix, 4% strandP06899
IDNA (197-mer)dna197——
JDNA (197-mer)dna197——
M, NSCFV20protein2275% helix, 52% strand—
UHistone H1.4protein7553% helix, 12% strandP10412

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111090.790.8186empty
24770.760.8444empty
34380.730.8447empty
44880.710.8141empty
57780.700.7774empty

Interfaces

41 interfaces between chains.

  • I–J · 8921 Ų buried · 683 hydrogen bonds · nucleic-nucleic
  • C–D · 2581 Ų buried · 21 hydrogen bonds · protein-protein
  • G–H · 2565 Ų buried · 23 hydrogen bonds · protein-protein
  • A–B · 2564 Ų buried · 21 hydrogen bonds · protein-protein
  • E–F · 2561 Ų buried · 24 hydrogen bonds · protein-protein

Compared structures

  • 7K5Y · Cryo-EM structure of a chromatosome containing human linker histone H1.4 · the same entry in another collection · chain U against U, TM-score 1.00

Analyse

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