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MolNFT v1 · #111045 · protein + DNA

HUAB-19BP

4YEW · DNA-binding protein hu-beta: “HUAB-19BP”. X-ray diffraction, 2 pockets (best druggability 0.47). MolNFT v1 #111045 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
4YEW
Type
protein + DNA
Length
162 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
DNA-binding protein hu-beta; Synthetic DNA strand; DNA-binding protein hu-alpha
UniProt
N4NVB4, P0ACF2
Pockets
2 · best druggability 0.47

Structure

x-ray diffraction · 4 distinct chains · 52% helix, 23% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADNA-binding protein hu-betaprotein7151% helix, 23% strandN4NVB4
BSynthetic DNA stranddna9——
DSynthetic DNA stranddna11——
CDNA-binding protein hu-alphaprotein7154% helix, 23% strandP0ACF2

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12670.470.7326empty
2760.290.7310empty

Interfaces

3 interfaces between chains.

  • A–C · 1886 Ų buried · 17 hydrogen bonds · protein-protein
  • B–D · 430 Ų buried · 37 hydrogen bonds · nucleic-nucleic
  • D–C · 248 Ų buried · 6 hydrogen bonds · protein-nucleic

Compared structures

  • 4YEW · HUab-19bp · the same entry in another collection · chain A against A, TM-score 1.00
  • P0ACF2 · AlphaFold monomer V2.0 prediction for DNA-binding protein hu-alpha (P0ACF2) · a predicted model of the same protein · chain C against A, TM-score 0.98

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