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MolNFT v1 · #109342 · protein + DNA

Crystal structure of human puf-a in complex with DNA

4WZW · Pumilio domain-containing protein KIAA0020: “Crystal structure of human puf-a in complex with DNA”. X-ray diffraction, 2 pockets (best druggability 0.81). MolNFT v1 #109342 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
4WZW
Type
protein + DNA
Length
535 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Pumilio domain-containing protein KIAA0020; DNA…
UniProt
Q15397
Pockets
2 · best druggability 0.81

Structure

x-ray diffraction · 3 distinct chains · 70% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APumilio domain-containing protein KIAA0020protein50570% helix, 0% strandQ15397
BDNA (5'-D(P*GP*GP*GP*GP*GP*GP*GP*GP*GP*GP*GP*GP*GP*G)-3')dna14——
CDNA (5'- D(P*CP*CP*CP*CP*CP*CP*CP*CP*CP*CP*CP*CP*CP*CP*CP*C)-3')dna16——

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111040.810.8390empty
2800.330.7415empty

Interfaces

3 interfaces between chains.

  • B–C · 662 Ų buried · 72 hydrogen bonds · nucleic-nucleic
  • A–B · 393 Ų buried · 4 hydrogen bonds · protein-nucleic
  • A–C · 297 Ų buried · 1 hydrogen bond · protein-nucleic

Compared structures

  • 4WZW · Crystal structure of human Puf-A in complex with DNA · the same entry in another collection · chain A against A, TM-score 1.00
  • Q15397 · AlphaFold monomer V2.0 prediction for pumilio homolog 3 (Q15397) · a predicted model of the same protein · chain A against A, TM-score 0.98

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