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Crystal structure of PBP3 complexed with ceftazidime

Analyse Crystal structure of PBP3 complexed with ceftazidime in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3PBO
Type
protein
Length
473 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Penicillin-binding protein 3
UniProt
Q51504
Ligands
CAZ
Pockets
3 · best druggability 0.64

Structure

x-ray diffraction · 1 distinct chain · 36% helix, 23% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APenicillin-binding protein 3protein47336% helix, 23% strandQ51504

Ligands and binding sites

  • CAZ · Acylated ceftazidime · ligand · 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, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14020.640.7838CAZ
21430.500.7931empty
3700.470.8320empty

Modifications

Observed in the structure: 1 covalent (covalent ligand).

Compared structures

  • 3PBO · Crystal structure of PBP3 complexed with ceftazidime · the same entry in another collection · chain A against A, TM-score 1.00

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