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MolNFT v1 · #152474 · protein + DNA

Complex structure of the HRP3 pwwp domain with a 10-bp gc-rich DNA

6IIR · Hepatoma-derived growth factor-related protein 3: “Complex structure of the HRP3 pwwp domain with a 10-bp gc-rich DNA”. X-ray diffraction, 2 pockets (best druggability 0.52). MolNFT v1 #152474 on GenesisL1: 3D structure, binding…

PDB
6IIR
Type
protein + DNA
Length
217 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Hepatoma-derived growth factor-related protein 3; 10-bp gc-rich DNA
UniProt
Q9Y3E1
Pockets
2 · best druggability 0.52

Structure

x-ray diffraction · 3 distinct chains · 21% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHepatoma-derived growth factor-related protein 3protein9821% helix, 21% strandQ9Y3E1
BHepatoma-derived growth factor-related protein 3protein9921% helix, 21% strandQ9Y3E1
C, D10-bp gc-rich DNAdna10——

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11370.520.8118empty
2580.390.8012empty

Interfaces

4 interfaces between chains.

  • C–D · 496 Ų buried · 69 hydrogen bonds · nucleic-nucleic
  • A–D · 179 Ų buried · 3 hydrogen bonds · protein-nucleic
  • A–C · 178 Ų buried · 4 hydrogen bonds · protein-nucleic
  • B–C · 150 Ų buried · 3 hydrogen bonds · protein-nucleic

Compared structures

  • 6IIR · Complex structure of the HRP3 PWWP domain with a 10-bp GC-rich DNA · the same entry in another collection · chain C against C, TM-score 1.00
  • Q9Y3E1 · AlphaFold monomer V2.0 prediction for hepatoma-derived growth factor- related protein 3… · a predicted model of the same protein · chain A against A, TM-score 0.94

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