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MolNFT v1 · #58314 · protein

Crystal structure of puromycin hydrolase S511A mutant

3AZP · Aminopeptidase: “Crystal structure of puromycin hydrolase S511A mutant”. X-ray diffraction, 1 ligand (SO4), 9 pockets (best druggability 0.83). MolNFT v1 #58314 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
3AZP
Type
protein
Length
1,322 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Aminopeptidase
UniProt
Q2HXD9
Ligands
SO4
Pockets
9 · best druggability 0.83

Structure

x-ray diffraction · 1 distinct chain · 16% helix, 33% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BAminopeptidaseprotein66116% helix, 33% strandQ2HXD9

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 5 copies · chains A, B

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

Pockets

9 pockets found on a 1 Å grid, 6 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111990.830.84104empty
211250.830.84100empty
311340.800.8266empty
44730.710.8181empty
54790.670.7836empty

Interfaces

1 interface between chains.

  • A–B · 670 Ų buried · 10 hydrogen bonds · protein-protein

Compared structures

  • 3AZP · Crystal structure of puromycin hydrolase S511A mutant · the same entry in another collection · chain A against A, TM-score 1.00

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