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MolNFT v1 · #75417 · protein

Crystal structure of the candida albicans methionine synthase by surface entropy reduction, alanine variant with zinc

3PPG · 5-methyltetrahydropteroyltriglutamate--homocysteine…: “Crystal structure of the candida albicans methionine synthase by surface entropy reduction, alanine variant…”. X-ray diffraction, 1 ligand (ZN), 12 pockets (best druggability…

PDB
3PPG
Type
protein
Length
740 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
5-methyltetrahydropteroyltriglutamate--homocysteine methyltransferase
EC
2.1.1.14
UniProt
P82610
Ligands
ZN
Pockets
12 · best druggability 0.78

Structure

x-ray diffraction · 1 distinct chain · 48% helix, 14% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A5-methyltetrahydropteroyltriglutamate--homocysteine methyltransferase (EC 2.1.1.14)protein74048% helix, 14% strandP82610

Ligands and binding sites

  • ZN · Zinc ion · metal · chains A

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

Pockets

12 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11050.780.9825empty
26310.730.8056empty
33230.600.7744empty
41860.580.8120empty
5850.520.8420empty

Compared structures

  • 3PPG · Crystal structure of the Candida albicans methionine synthase by surface entropy… · the same entry in another collection · chain A against A, TM-score 1.00
  • P82610 · AlphaFold monomer V2.0 prediction for 5-methyltetrahydropteroyltriglutamate--homocysteine… · a predicted model of the same protein · chain A against A, TM-score 0.95

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