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MolNFT v1 · #55184 · protein

Methyltransferase bound with methyltetrahydrofolate

2YCJ · 5-methyltetrahydrofolate CORRINOID/IRON sulfur protein…: “Methyltransferase bound with methyltetrahydrofolate”. X-ray diffraction, 2 ligands (C2F, SO4), 2 pockets (best druggability 0.55). MolNFT v1 #55184 on GenesisL1: 3D…

PDB
2YCJ
Type
protein
Length
271 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
5-methyltetrahydrofolate CORRINOID/IRON sulfur protein methyltransferase
UniProt
Q3ACR9
Ligands
C2F, SO4
Pockets
2 · best druggability 0.55

Structure

x-ray diffraction · 1 distinct chain · 50% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A5-methyltetrahydrofolate CORRINOID/IRON sulfur protein methyltransferaseprotein27150% helix, 15% strandQ3ACR9

Ligands and binding sites

  • C2F · 5-methyl-5,6,7,8-tetrahydrofolic acid · ligand · chains A
  • SO4 · Sulfate ion · ion · 5 copies · chains A
  • GOL · Glycerol · additive · 3 copies · 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
13040.550.7637GOL, C2F
2750.450.8225empty

Compared structures

  • 2YCJ · methyltransferase bound with methyltetrahydrofolate · the same entry in another collection · chain A against A, TM-score 1.00

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