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Phosphoethanolamine methyltransferase from plasmodium falciparum in complex with sinefungin and PO4

Analyse Phosphoethanolamine methyltransferase from plasmodium falciparum in complex… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3UJ8
Type
protein
Length
258 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Phosphoethanolamine N-methyltransferase
UniProt
Q6T755
Ligands
SFG, PO4
Pockets
1 · best druggability 0.79

Structure

x-ray diffraction · 1 distinct chain · 49% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APhosphoethanolamine N-methyltransferaseprotein25849% helix, 21% strandQ6T755

Ligands and binding sites

  • SFG · Sinefungin · ligand · chains A
  • PO4 · Phosphate ion · ion · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14540.790.8764SFG, PO4

Compared structures

  • 3UJ8 · Phosphoethanolamine methyltransferase from Plasmodium falciparum in complex with… · the same entry in another collection · chain A against A, TM-score 1.00

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