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MolNFT v1 · #61229 · protein

The crystal structure of teicoplanin pseudoaglycone deacetylase ORF2

3DFF · Teicoplanin pseudoaglycone deacetylases ORF2: “The crystal structure of teicoplanin pseudoaglycone deacetylase ORF2”. X-ray diffraction, 1 ligand (ZN), 3 pockets (best druggability 0.69). MolNFT v1 #61229 on GenesisL1: 3D structure…

PDB
3DFF
Type
protein
Length
266 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Teicoplanin pseudoaglycone deacetylases ORF2
UniProt
Q6ZZJ1
Ligands
ZN
Pockets
3 · best druggability 0.69

Structure

x-ray diffraction · 1 distinct chain · 43% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ATeicoplanin pseudoaglycone deacetylases ORF2protein26643% helix, 17% strandQ6ZZJ1

Ligands and binding sites

  • ZN · Zinc ion · metal · chains A
  • PG4 · Tetraethylene glycol · additive · 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
13900.690.8134PG4
21310.440.7625empty
3780.330.7517empty

Modifications

Observed in the structure: 3 modified (engineered).

Compared structures

  • 3DFF · The crystal structure of teicoplanin pseudoaglycone deacetylase Orf2 · the same entry in another collection · chain A against A, TM-score 1.00

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