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MolNFT v1 · #70268 · protein

Crystal structure of fructosyltransferase (wild-type) from a. japonicus in complex with glucose

3LFI: “Crystal structure of fructosyltransferase (wild-type) from a. japonicus in complex with glucose”. X-ray diffraction, 1 ligand (BGC), 15 pockets (best druggability 0.76). MolNFT v1 #70268 on GenesisL1: 3D structure, binding sites and…

PDB
3LFI
Type
protein
Length
1,268 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Fructosyltransferase
Ligands
BGC
Pockets
15 · best druggability 0.76

Structure

x-ray diffraction · 1 distinct chain · 10% helix, 43% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BFructosyltransferaseprotein63410% helix, 43% strand—

Ligands and binding sites

  • BGC · beta-D-glucopyranose · sugar · 2 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11050.760.9622empty
2590.751.0019empty
3640.750.9919empty
44380.700.8137BGC
54450.680.8041BGC

Interfaces

1 interface between chains.

  • A–B · 946 Ų buried · 12 hydrogen bonds · protein-protein

Compared structures

  • 3LFI · Crystal structure of fructosyltransferase (wild-type) from A. japonicus in complex with… · the same entry in another collection · chain A against A, TM-score 1.00

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