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MolNFT v1 · #92027 · protein

Crystal structure of a leucine aminopeptidase precursor (BT_2548) from bacteroides thetaiotaomicron vpi-5482 at 1.30 a resolution

4FUU: “Crystal structure of a leucine aminopeptidase precursor (BT_2548) from bacteroides thetaiotaomicron vpi-5482…”. X-ray diffraction, 3 ligands (UNL, ZN, PO4), 1 pocket (best druggability 0.46). MolNFT v1 #92027 on GenesisL1: 3D…

PDB
4FUU
Type
protein
Length
290 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Leucine aminopeptidase
UniProt
Q8A4P9
Ligands
UNL, ZN, PO4
Pockets
1 · best druggability 0.46

Structure

x-ray diffraction · 1 distinct chain · 38% helix, 19% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ALeucine aminopeptidaseprotein29038% helix, 19% strandQ8A4P9

Ligands and binding sites

  • UNL · Unknown ligand · ligand · chains A
  • ZN · Zinc ion · metal · chains A
  • PO4 · Phosphate ion · ion · chains A
  • EDO · 1,2-ethanediol · additive · 3 copies · chains A

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11090.460.7920UNL

Modifications

Observed in the structure: 2 modified (engineered).

Compared structures

  • 4FUU · Crystal structure of a leucine aminopeptidase precursor (BT_2548) from Bacteroides… · the same entry in another collection · chain A against A, TM-score 1.00

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