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Crystal structure a of CENAP1-H2A-H2B complex

Analyse Crystal structure a of CENAP1-H2A-H2B complex in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6K00
Type
protein
Length
712 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Nucleosome assembly protein; Histone H2B 1,HISTONE H2A
UniProt
Q19007, P04255, P09588
Pockets
6 · best druggability 0.76

Structure

x-ray diffraction · 3 distinct chains · 53% helix, 13% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ANucleosome assembly proteinprotein26347% helix, 17% strandQ19007
BNucleosome assembly proteinprotein26948% helix, 16% strandQ19007
DHistone H2B 1,HISTONE H2Aprotein18068% helix, 3% strandP04255, P09588

Pockets

6 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15980.760.8265empty
23120.670.8254empty
32680.530.7524empty
41660.450.7520empty
5580.290.7415empty

Interfaces

3 interfaces between chains.

  • A–B · 4539 Ų buried · 64 hydrogen bonds · protein-protein
  • A–D · 527 Ų buried · 12 hydrogen bonds · protein-protein
  • B–D · 388 Ų buried · 2 hydrogen bonds · protein-protein

Compared structures

  • 6K00 · Crystal structure A of ceNAP1-H2A-H2B complex · the same entry in another collection · chain A against A, TM-score 1.00
  • P09588 · AlphaFold monomer V2.0 prediction for histone H2A (P09588) · a predicted model of the same protein · chain D against A, TM-score 0.48
  • P04255 · AlphaFold monomer V2.0 prediction for histone H2B 1 (P04255) · a predicted model of the same protein · chain D against A, TM-score 0.47

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