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Crystal structure of a putative oxoacyl-(acyl carrier protein) reductase from brucella ovis

Analyse Crystal structure of a putative oxoacyl-(acyl carrier protein) reductase from… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4Z0T
Type
protein
Length
244 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Oxidoreductase, short-chain DEHYDROGENASE/REDUCTASE family
UniProt
A5VP18
Ligands
BR
Pockets
2 · best druggability 0.60

Structure

x-ray diffraction · 1 distinct chain · 46% helix, 14% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AOxidoreductase, short-chain DEHYDROGENASE/REDUCTASE familyprotein24446% helix, 14% strandA5VP18

Ligands and binding sites

  • BR · Bromide ion · ion · 4 copies · chains A
  • EDO · 1,2-ethanediol · additive · 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, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12550.600.8031BR
2940.410.7824EDO

Compared structures

  • 4Z0T · Crystal Structure of a putative oxoacyl-(acyl carrier protein) reductase from Brucella… · the same entry in another collection · chain A against A, TM-score 1.00

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