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MolNFT v1 · #84881 · protein

Crystal structure of POFUT1 in complex with GDP (high resolution dataset)

3ZY2 · Putative GDP-fucose protein O-fucosyltransferase 1: “Crystal structure of POFUT1 in complex with GDP (high resolution dataset)”. X-ray diffraction, 2 ligands (GDP, MN), 4 pockets (best druggability 0.61). MolNFT v1 #84881 on…

PDB
3ZY2
Type
protein
Length
342 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Putative GDP-fucose protein O-fucosyltransferase 1
EC
2.4.1.221
UniProt
Q18014
Ligands
GDP, MN
Pockets
4 · best druggability 0.61

Structure

x-ray diffraction · 1 distinct chain · 42% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APutative GDP-fucose protein O-fucosyltransferase 1 (EC 2.4.1.221)protein34242% helix, 15% strandQ18014

Ligands and binding sites

  • GDP · Guanosine-5'-diphosphate · ligand · chains A
  • MN · Manganese (II) ion · metal · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12460.610.8035MN, GDP
2860.450.8016empty
3800.380.7717empty
4750.370.7723empty

Modifications

Observed in the structure: 4 disulfide (disulfide).

Compared structures

  • 3ZY2 · Crystal structure of POFUT1 in complex with GDP (High resolution dataset) · the same entry in another collection · chain A against A, TM-score 1.00
  • Q18014 · AlphaFold monomer V2.0 prediction for GDP-fucose protein O-fucosyltransferase 1 (Q18014) · a predicted model of the same protein · chain A against A, TM-score 1.00

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