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Crystal structure of cytochrome B domain of pyranose dehydrogenase from coprinopsis cinerea

Analyse Crystal structure of cytochrome B domain of pyranose dehydrogenase from… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6JT6
Type
protein
Length
195 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Extracellular pqq-dependent sugar dehydrogenase
UniProt
A0A0A8IDB7
Ligands
HEM, NAG
Pockets
1 · best druggability 0.57

Structure

x-ray diffraction · 1 distinct chain · 7% helix, 45% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AExtracellular pqq-dependent sugar dehydrogenaseprotein1957% helix, 45% strandA0A0A8IDB7

Ligands and binding sites

  • HEM · Protoporphyrin IX containing Fe · ligand · chains A
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · chains A
  • MPD · (4S)-2-methyl-2,4-pentanediol · additive · 2 copies · chains A
  • ACT · Acetate ion · additive · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11270.570.8427HEM

Modifications

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

Compared structures

  • 6JT6 · Crystal structure of cytochrome b domain of Pyranose Dehydrogenase from Coprinopsis… · the same entry in another collection · chain A against A, TM-score 1.00

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