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MolNFT v1 · #176892 · protein

Crystal structure of arabidopsis thaliana hppd complexed with 4- hydroxyphenylacetic acid

7E0X · 4-hydroxyphenylpyruvate dioxygenase: “Crystal structure of arabidopsis thaliana hppd complexed with 4- hydroxyphenylacetic acid”. X-ray diffraction, 2 ligands (4HP, CO), 2 pockets (best druggability 0.69). MolNFT v1 #176892 on…

PDB
7E0X
Type
protein
Length
384 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
4-hydroxyphenylpyruvate dioxygenase
EC
1.13.11.27
UniProt
P93836
Ligands
4HP, CO
Pockets
2 · best druggability 0.69

Structure

x-ray diffraction · 1 distinct chain · 29% helix, 33% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A4-hydroxyphenylpyruvate dioxygenase (EC 1.13.11.27)protein38429% helix, 33% strandP93836

Ligands and binding sites

  • 4HP · 4-hydroxyphenylacetate · ligand · chains A
  • CO · Cobalt (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, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14580.690.80414HP
2660.320.7612empty

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 7E0X · Crystal structure of Arabidopsis thaliana HPPD complexed with 4-hydroxyphenylacetic acid · the same entry in another collection · chain A against A, TM-score 1.00

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