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Cenp-a nucleosome bound by two copies of cenp-C(CD) and one copy cenp- N(NT)

Analyse Cenp-a nucleosome bound by two copies of cenp-C(CD) and one copy cenp- N(NT) in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6MUO
Type
protein + DNA
Length
1,300 residues
Chains
13
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Histone H3-like centromeric protein a; Histone H4; Histone H2A type 1-C; Histone H2B type…
UniProt
P49450, P62805, Q93077, Q5QNW6, Q03188, Q96H22
Pockets
20 · best druggability 0.86

Structure

electron microscopy · 11 distinct chains · 46% helix, 7% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, EHistone H3-like centromeric protein aprotein9956% helix, 2% strandP49450
BHistone H4protein9448% helix, 4% strandP62805
CHistone H2A type 1-Cprotein10350% helix, 5% strandQ93077
D, HHistone H2B type 2-Fprotein9264% helix, 3% strandQ5QNW6
FHistone H4protein8055% helix, 5% strandP62805
GHistone H2A type 1-Cprotein10550% helix, 6% strandQ93077
IDNA/RNA (147-mer)dna147——
JDNA/RNA (147-mer)dna147——
KCentromere protein Cprotein190% helix, 0% strandQ03188
LCentromere protein Cprotein180% helix, 0% strandQ03188
MCentromere protein Nprotein20533% helix, 17% strandQ96H22

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111250.860.87118empty
28080.850.8885empty
36470.810.8667empty
45820.780.8561empty
58010.770.8177empty

Interfaces

52 interfaces between chains.

  • I–J · 6301 Ų buried · 566 hydrogen bonds · nucleic-nucleic
  • A–B · 2720 Ų buried · 7 hydrogen bonds · protein-protein
  • E–F · 2675 Ų buried · 6 hydrogen bonds · protein-protein
  • G–H · 2641 Ų buried · 15 hydrogen bonds · protein-protein
  • C–D · 2630 Ų buried · 21 hydrogen bonds · protein-protein

Compared structures

  • 6MUO · CENP-A nucleosome bound by two copies of CENP-C(CD) and one copy CENP-N(NT) · the same entry in another collection · chain M against M, TM-score 1.00

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