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Structure of YEPL2A K291W in complex with tetragalacturonic acid

Analyse Structure of YEPL2A K291W in complex with tetragalacturonic acid in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6OJK
Type
protein
Length
542 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Periplasmic pectate lyase
UniProt
A0A0T9S209
Ligands
ADA
Pockets
4 · best druggability 0.69

Structure

x-ray diffraction · 1 distinct chain · 45% helix, 14% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APeriplasmic pectate lyaseprotein54245% helix, 14% strandA0A0T9S209

Ligands and binding sites

  • ADA · alpha-D-galactopyranuronic acid · sugar · 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

4 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17420.690.7671ADA
22830.640.8128empty
31280.480.7919empty
4550.440.8316empty

Compared structures

  • 6OJK · Structure of YePL2A K291W in Complex with Tetragalacturonic Acid · the same entry in another collection · chain A against A, TM-score 1.00

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