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MolNFT v1 · #54771 · protein

Crystal structure of the phosphoenolpyruvate-binding domain of enzyme I in complex with phosphoenolpyruvate from the thermoanaerobacter tengcongensis pep-sugar phosphotransferase system (pts)

2XZ7 · Phosphoenolpyruvate-protein kinase (pts system ei component…: “Crystal structure of the phosphoenolpyruvate-binding domain of enzyme I in complex with phosphoenolpyruvate…”. X-ray diffraction, 2 ligands (PEP, MG), 2 pockets (best…

PDB
2XZ7
Type
protein
Length
324 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Phosphoenolpyruvate-protein kinase (pts system ei component in bacteria)
EC
2.7.3.9
UniProt
Q8R7R4
Ligands
PEP, MG
Pockets
2 · best druggability 0.51

Structure

x-ray diffraction · 1 distinct chain · 52% helix, 12% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APhosphoenolpyruvate-protein kinase (pts system ei component in bacteria) (EC 2.7.3.9)protein32452% helix, 12% strandQ8R7R4

Ligands and binding sites

  • PEP · Phosphoenolpyruvate · 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

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11590.510.7927PEP, MG
2590.330.7613empty

Compared structures

  • 2XZ7 · Crystal structure of the phosphoenolpyruvate-binding domain of enzyme I in complex with… · the same entry in another collection · chain A against A, TM-score 1.00

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