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MolNFT v1 · #152481 · protein

Crystal structure of deacetylase triple mutant (ORF2*T) that involving in teicoplanin biosynthetic pathway

6IIY: “Crystal structure of deacetylase triple mutant (ORF2*T) that involving in teicoplanin biosynthetic pathway”. X-ray diffraction, 1 ligand (CO), 2 pockets (best druggability 0.49). MolNFT v1 #152481 on GenesisL1: 3D structure, binding…

PDB
6IIY
Type
protein
Length
237 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Deacetylase
UniProt
Q6ZZJ1
Ligands
CO
Pockets
2 · best druggability 0.49

Structure

x-ray diffraction · 1 distinct chain · 48% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADeacetylaseprotein23748% helix, 16% strandQ6ZZJ1

Ligands and binding sites

  • CO · Cobalt (II) ion · metal · chains A
  • IMD · Imidazole · additive · 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, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11680.490.7721IMD, CO
2910.360.7419empty

Compared structures

  • 6IIY · Crystal structure of deacetylase triple mutant (Orf2*T) that involving in teicoplanin… · the same entry in another collection · chain A against A, TM-score 1.00

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