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MolNFT v1 · #26039 · protein

Crystal structure of arabinofuranosidase complexed with arabinose

1WD4 · Alpha-L-arabinofuranosidase B: “Crystal structure of arabinofuranosidase complexed with arabinose”. X-ray diffraction, 2 ligands (AHR, NAG), 2 pockets (best druggability 0.56). MolNFT v1 #26039 on GenesisL1: 3D structure, binding…

PDB
1WD4
Type
protein
Length
482 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Alpha-L-arabinofuranosidase B
EC
3.2.1.55
Ligands
AHR, NAG
Pockets
2 · best druggability 0.56

Structure

x-ray diffraction · 1 distinct chain · 10% helix, 38% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAlpha-L-arabinofuranosidase B (EC 3.2.1.55)protein48210% helix, 38% strand—

Ligands and binding sites

  • AHR · alpha-L-arabinofuranose · sugar · 3 copies · chains A
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 2 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, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11430.560.8227empty
21520.500.7924empty

Modifications

Observed in the structure: 4 disulfide, 1 glycan (disulfide, N-glycosylation).

Compared structures

  • 1WD4 · Crystal structure of arabinofuranosidase complexed with arabinose · the same entry in another collection · chain A against A, TM-score 1.00

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