GL1X · GenesisL1 explorer

MolNFT v1 · #185000 · protein

Cenp-hik 3-protein complex

7PB4 · Centromere protein H: “Cenp-hik 3-protein complex”. X-ray diffraction, 3 pockets (best druggability 0.65). MolNFT v1 #185000 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7PB4
Type
protein
Length
353 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Centromere protein H; Centromere protein I; Centromere protein K
UniProt
Q9H3R5, Q92674, Q9BS16
Pockets
3 · best druggability 0.65

Structure

x-ray diffraction · 3 distinct chains · 61% helix, 4% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
HCentromere protein Hprotein4764% helix, 0% strandQ9H3R5
ICentromere protein Iprotein21565% helix, 2% strandQ92674
KCentromere protein Kprotein9149% helix, 10% strandQ9BS16

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13400.650.7936empty
21170.410.7621empty
3790.370.7721empty

Interfaces

3 interfaces between chains.

  • H–K · 1368 Ų buried · 5 hydrogen bonds · protein-protein
  • H–I · 892 Ų buried · 10 hydrogen bonds · protein-protein
  • I–K · 172 Ų buried · 4 hydrogen bonds · protein-protein

Compared structures

  • 7PB4 · Cenp-HIK 3-protein complex · the same entry in another collection · chain H against H, TM-score 1.00
  • Q92674 · AlphaFold monomer V2.0 prediction for centromere protein I (Q92674) · a predicted model of the same protein · chain I against A, TM-score 0.93
  • Q9BS16 · AlphaFold monomer V2.0 prediction for centromere protein K (Q9BS16) · a predicted model of the same protein · chain K against A, TM-score 0.85
  • Q9H3R5 · AlphaFold monomer V2.0 prediction for centromere protein H (Q9H3R5) · a predicted model of the same protein · chain H against A, TM-score 0.80

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