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Crystal structure of uroporphyrinogen decarboxylase from aquifex aeolicus

Analyse Crystal structure of uroporphyrinogen decarboxylase from aquifex aeolicus in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2EJA
Type
protein
Length
673 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Uroporphyrinogen decarboxylase
EC
4.1.1.37
UniProt
O66667
Pockets
4 · best druggability 0.76

Structure

x-ray diffraction · 2 distinct chains · 51% helix, 12% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AUroporphyrinogen decarboxylase (EC 4.1.1.37)protein33751% helix, 12% strandO66667
BUroporphyrinogen decarboxylase (EC 4.1.1.37)protein33651% helix, 12% strandO66667

Ligands and binding sites

  • ACT · Acetate ion · additive · chains A

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

Pockets

4 pockets found on a 1 Å grid, 4 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13910.760.8636empty
23690.750.8538empty
33740.700.8255empty
43240.600.7830empty

Interfaces

1 interface between chains.

  • A–B · 1139 Ų buried · 18 hydrogen bonds · protein-protein

Compared structures

  • 2EJA · Crystal Structure Of Uroporphyrinogen Decarboxylase From Aquifex aeolicus · the same entry in another collection · chain A against A, TM-score 1.00
  • O66667 · AlphaFold monomer V2.0 prediction for uroporphyrinogen decarboxylase (O66667) · a predicted model of the same protein · chain B against A, TM-score 0.99

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