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MolNFT v1 · #177730 · protein

Glycosyltransferase in complex with udp and st

7ES1: “Glycosyltransferase in complex with udp and st”. X-ray diffraction, 2 ligands (UDP, JDF), 3 pockets (best druggability 0.80). MolNFT v1 #177730 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7ES1
Type
protein
Length
408 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Glycosyltransferase
EC
2.4.1.-
UniProt
Q0DPB7
Ligands
UDP, JDF
Pockets
3 · best druggability 0.80

Structure

x-ray diffraction · 1 distinct chain · 45% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGlycosyltransferase (EC 2.4.1.-)protein40845% helix, 15% strandQ0DPB7

Ligands and binding sites

  • UDP · Uridine-5'-diphosphate · ligand · chains A
  • JDF · steviol-19-o-glucoside · ligand · 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
16550.800.8569UDP, JDF
2700.520.8622empty
3720.340.7515empty

Compared structures

  • 7ES1 · glycosyltransferase in complex with UDP and ST · the same entry in another collection · chain A against A, TM-score 1.00

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