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MolNFT v2 · #179789 · protein

Mechanism of enolase: the crystal structure of enolase-MG2+-PHOSPHOGLYCERATE(SLASH) phosphoenolpyruvate complex at 2.2-ångströms resolution

7ENL: “Mechanism of enolase: the crystal structure of enolase-MG2+-PHOSPHOGLYCERATE(SLASH) phosphoenolpyruvate…”. X-ray diffraction at 2.2, 2 ligands (2PG, MG), 3 pockets (best druggability 0.59). MolNFT v2 #179789 on GenesisL1: 3D…

PDB
7ENL
Type
protein
Length
436 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
2.2
Source
Saccharomyces cerevisiae
Molecule
Enolase
EC
4.2.1.11
UniProt
P00924
Ligands
2PG, MG
Pockets
3 · best druggability 0.59

Structure

x-ray diffraction · resolution 2.2 · 1 distinct chain · 43% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AEnolase (EC 4.2.1.11)protein43643% helix, 17% strandP00924

Ligands and binding sites

  • 2PG · 2-phosphoglyceric acid · ligand · chains A
  • MG · Magnesium ion · metal · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11000.590.87272PG
2960.540.8521empty
3760.440.8120empty

Compared structures

  • 7ENL · Mechanism of enolase: the crystal structure of enolase-MG2+- PHOSPHOGLYCERATE(SLASH)… · the same entry in another collection · chain A against A, TM-score 1.00
  • P00924 · AlphaFold monomer V2.0 prediction for enolase 1 (P00924) · a predicted model of the same protein · chain A against A, TM-score 0.99

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