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MolNFT v1 · #125043 · protein

The structure of arabidopsis thaliana FUT1 mutant R284K in complex with GDP

5KX6 · Galactoside 2-alpha-L-fucosyltransferase: “The structure of arabidopsis thaliana FUT1 mutant R284K in complex with GDP”. X-ray diffraction, 1 ligand (GDP), 11 pockets (best druggability 0.72). MolNFT v1 #125043 on GenesisL1: 3D…

PDB
5KX6
Type
protein
Length
890 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Galactoside 2-alpha-L-fucosyltransferase
EC
2.4.1.69
UniProt
Q9SWH5
Ligands
GDP
Pockets
11 · best druggability 0.72

Structure

x-ray diffraction · 2 distinct chains · 37% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGalactoside 2-alpha-L-fucosyltransferase (EC 2.4.1.69)protein44038% helix, 16% strandQ9SWH5
BGalactoside 2-alpha-L-fucosyltransferase (EC 2.4.1.69)protein45037% helix, 15% strandQ9SWH5

Ligands and binding sites

  • GDP · Guanosine-5'-diphosphate · ligand · 2 copies · chains A, B
  • GOL · Glycerol · additive · chains B
  • EDO · 1,2-ethanediol · additive · chains B
  • MES · 2-(N-morpholino)-ethanesulfonic acid · additive · chains B

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

Pockets

11 pockets found on a 1 Å grid, 8 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11360.720.9230empty
2820.600.8922empty
3810.590.8819empty
4600.560.8919GOL
52470.560.7843empty

Interfaces

1 interface between chains.

  • A–B · 458 Ų buried · 3 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 10 disulfide (disulfide).

Compared structures

  • 5KX6 · The structure of Arabidopsis thaliana FUT1 Mutant R284K in complex with GDP · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9SWH5 · AlphaFold monomer V2.0 prediction for galactoside 2-alpha-L- fucosyltransferase (Q9SWH5) · a predicted model of the same protein · chain B against A, TM-score 1.00

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