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MolNFT v1 · #141556 · protein

Crystal structure of 4-hydroxyphenylpyruvic acid bound aere from microcystis aeruginosa

5ZBF · Cupin domain protein: “Crystal structure of 4-hydroxyphenylpyruvic acid bound aere from microcystis aeruginosa”. X-ray diffraction, 2 ligands (ENO, FE2), 2 pockets (best druggability 0.62). MolNFT v1 #141556 on GenesisL1: 3D…

PDB
5ZBF
Type
protein
Length
210 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Cupin domain protein
UniProt
L8NZJ8
Ligands
ENO, FE2
Pockets
2 · best druggability 0.62

Structure

x-ray diffraction · 1 distinct chain · 0% helix, 59% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACupin domain proteinprotein2100% helix, 59% strandL8NZJ8

Ligands and binding sites

  • ENO · 3-(4-hydroxy-phenyl)pyruvic acid · ligand · chains A
  • FE2 · Fe (II) ion · metal · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11200.620.8628ENO
21200.590.8529empty

Compared structures

  • 5ZBF · Crystal structure of 4-hydroxyphenylpyruvic acid bound AerE from Microcystis aeruginosa · the same entry in another collection · chain A against A, TM-score 1.00

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