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MolNFT v1 · #184365 · protein

Crystal structure of PBP3 from P. aeruginosa

7ONZ · Peptidoglycan D,D-transpeptidase ftsi: “Crystal structure of PBP3 from P. aeruginosa”. X-ray diffraction, 3 pockets (best druggability 0.54). MolNFT v1 #184365 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7ONZ
Type
protein
Length
493 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Peptidoglycan D,D-transpeptidase ftsi
EC
3.4.16.4
UniProt
G3XD46
Pockets
3 · best druggability 0.54

Structure

x-ray diffraction · 1 distinct chain · 34% helix, 24% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APeptidoglycan D,D-transpeptidase ftsi (EC 3.4.16.4)protein49334% helix, 24% strandG3XD46

Ligands and binding sites

  • GOL · Glycerol · additive · 2 copies · 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
12390.540.7734empty
2720.430.8020empty
31060.390.7623empty

Compared structures

  • 7ONZ · Crystal structure of PBP3 from P. aeruginosa · the same entry in another collection · chain A against A, TM-score 1.00
  • G3XD46 · AlphaFold monomer V2.0 prediction for peptidoglycan D,D-transpeptidase ftsi (G3XD46) · a predicted model of the same protein · chain A against A, TM-score 0.97

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