GL1X · GenesisL1 explorer

MolNFT v1 · #108047 · protein

MCM2-histone complex

4UUZ · Histone H3: “MCM2-histone complex”. X-ray diffraction, 1 pocket (best druggability 0.41). MolNFT v1 #108047 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
4UUZ
Type
protein
Length
209 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Histone H3; Histone H4; DNA replication licensing factor MCM2
EC
3.6.4.12
UniProt
P02299, P84040, P49736
Pockets
1 · best druggability 0.41

Structure

x-ray diffraction · 3 distinct chains · 57% helix, 5% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHistone H3protein7869% helix, 5% strandP02299
BHistone H4protein7864% helix, 5% strandP84040
CDNA replication licensing factor MCM2 (EC 3.6.4.12)protein5330% helix, 6% strandP49736

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1780.410.7915empty

Interfaces

3 interfaces between chains.

  • A–B · 2206 Ų buried · 18 hydrogen bonds · protein-protein
  • B–C · 1234 Ų buried · 22 hydrogen bonds · protein-protein
  • A–C · 853 Ų buried · 19 hydrogen bonds · protein-protein

Compared structures

  • 4UUZ · MCM2-histone complex · the same entry in another collection · chain A against A, TM-score 1.00
  • P02299 · AlphaFold monomer V2.0 prediction for histone H3 (P02299) · a predicted model of the same protein · chain A against A, TM-score 0.96
  • P84040 · AlphaFold monomer V2.0 prediction for histone H4 (P84040) · a predicted model of the same protein · chain B against A, TM-score 0.92
  • P49736 · AlphaFold monomer V2.0 prediction for DNA replication licensing factor MCM2 (P49736) · a predicted model of the same protein · chain C against A, TM-score 0.40

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