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X-ray structure of lactobacillus brevis alcohol dehydrogenase mutant T102E_Q126K

Analyse X-ray structure of lactobacillus brevis alcohol dehydrogenase mutant T102E_Q126K in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6Y15
Type
protein
Length
251 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
R-specific alcohol dehydrogenase
UniProt
Q84EX5
Ligands
MG
Pockets
1 · best druggability 0.71

Structure

x-ray diffraction · 1 distinct chain · 47% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AR-specific alcohol dehydrogenaseprotein25147% helix, 16% strandQ84EX5

Ligands and binding sites

  • MG · Magnesium ion · metal · chains A
  • EDO · 1,2-ethanediol · additive · 14 copies · 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
15560.710.7942EDO

Compared structures

  • 6Y15 · X-ray structure of Lactobacillus brevis alcohol dehydrogenase mutant T102E_Q126K · the same entry in another collection · chain A against A, TM-score 1.00

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