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MolNFT v1 · #39090 · protein

Crystal structure of a 3D domain-swapped dimer of protein HI0395 from haemophilus influenzae

2HJ1 · Hypothetical protein: “Crystal structure of a 3D domain-swapped dimer of protein HI0395 from haemophilus influenzae”. X-ray diffraction, 1 ligand (SO4), 1 pocket (best druggability 0.47). MolNFT v1 #39090 on GenesisL1: 3D structure…

PDB
2HJ1
Type
protein
Length
157 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Hypothetical protein
UniProt
Q4QNE7
Ligands
SO4
Pockets
1 · best druggability 0.47

Structure

x-ray diffraction · 2 distinct chains · 15% helix, 38% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHypothetical proteinprotein7716% helix, 42% strandQ4QNE7
BHypothetical proteinprotein8015% helix, 35% strandQ4QNE7

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 4 copies · chains A, B

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11610.470.7626empty

Interfaces

1 interface between chains.

  • A–B · 2734 Ų buried · 51 hydrogen bonds · protein-protein

Compared structures

  • 2HJ1 · Crystal structure of a 3D domain-swapped dimer of protein HI0395 from Haemophilus… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q4QNE7 · AlphaFold monomer V2.0 prediction for protein rnfh (Q4QNE7) · a predicted model of the same protein · chain A against A, TM-score 0.66

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