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Crystal structure of lanthanide-dependent alcohol dehydrogenase pedh from pseudomonas putida KT2440

Analyse Crystal structure of lanthanide-dependent alcohol dehydrogenase pedh from… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6ZCV
Type
protein
Length
562 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Quinoprotein ethanol dehydrogenase
EC
1.1.2.8
UniProt
Q88JH0
Ligands
PQQ, CA, PR
Pockets
3 · best druggability 0.71

Structure

x-ray diffraction · 1 distinct chain · 7% helix, 41% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AQuinoprotein ethanol dehydrogenase (EC 1.1.2.8)protein5627% helix, 41% strandQ88JH0

Ligands and binding sites

  • PQQ · Pyrroloquinoline quinone · ligand · chains A
  • CA · Calcium ion · metal · chains A
  • PR · Praseodymium ion · metal · chains A
  • GOL · Glycerol · additive · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12140.710.8741PQQ, GOL
21030.400.7723empty
3720.300.7312empty

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 6ZCV · Crystal structure of lanthanide-dependent alcohol dehydrogenase PedH from Pseudomonas… · the same entry in another collection · chain A against A, TM-score 1.00

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