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Crystal structure of aspergillus flavus fadgdh in complex with D- glucono-1,5-lactone

Analyse Crystal structure of aspergillus flavus fadgdh in complex with D… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4YNU
Type
protein
Length
569 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Glucose oxidase, putative
EC
1.1.5.9
UniProt
B8MX95
Ligands
LGC, FAD
Pockets
2 · best druggability 0.83

Structure

x-ray diffraction · 1 distinct chain · 33% helix, 22% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGlucose oxidase, putative (EC 1.1.5.9)protein56933% helix, 22% strandB8MX95

Ligands and binding sites

  • LGC · D-glucono-1,5-lactone · ligand · 2 copies · chains A
  • FAD · Flavin-adenine dinucleotide · ligand · 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, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16000.830.8870FAD, LGC
2720.370.7718empty

Compared structures

  • 4YNU · Crystal structure of Aspergillus flavus FADGDH in complex with D-glucono-1,5-lactone · the same entry in another collection · chain A against A, TM-score 1.00

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