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MolNFT v1 · #123592 · protein

Bdellovibrio bacteriovorus peptidoglycan deacetylase BD3279

5JP6 · Putative polysaccharide deacetylase: “Bdellovibrio bacteriovorus peptidoglycan deacetylase BD3279”. X-ray diffraction, 2 ligands (ZN, MG), 2 pockets (best druggability 0.76). MolNFT v1 #123592 on GenesisL1: 3D structure, binding…

PDB
5JP6
Type
protein
Length
339 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Putative polysaccharide deacetylase
EC
3.5.1.-
UniProt
Q6MI90
Ligands
ZN, MG
Pockets
2 · best druggability 0.76

Structure

x-ray diffraction · 1 distinct chain · 52% helix, 12% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APutative polysaccharide deacetylase (EC 3.5.1.-)protein33952% helix, 12% strandQ6MI90

Ligands and binding sites

  • ZN · Zinc ion · metal · chains A
  • MG · Magnesium ion · metal · 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
14580.760.8547empty
2550.360.7816empty

Modifications

Observed in the structure: 1 disulfide, 1 modified (disulfide, nonstandard).

Compared structures

  • 5JP6 · Bdellovibrio bacteriovorus peptidoglycan deacetylase Bd3279 · the same entry in another collection · chain A against A, TM-score 1.00

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