› 4oom

X-ray diffraction
2Å resolution

Crystal structure of PBP3 in complex with BAL30072 ((2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-{[(1,5-dihydroxy-4-oxo-1,4-dihydropyridin-2-yl)methoxy]imino}-N-{(2S)-1-hydroxy-3-methyl-3-[(sulfooxy)amino]butan-2-yl}ethanamide)

Released:
DOI: 10.2210/pdb4oom/pdb
PDB entry 4oom coloured by chain, front view.
PDB entry 4oom coloured by chain, side view.
PDB entry 4oom coloured by chain, top view.
Source organism: Pseudomonas aeruginosa PA1R
Primary publication:
Siderophore receptor-mediated uptake of lactivicin analogues in gram-negative bacteria.
Starr J, Brown MF, Aschenbrenner L, Caspers N, Che Y, Gerstenberger BS, Huband M, Knafels JD, Lemmon MM, Li C, McCurdy SP, McElroy E, Rauckhorst MR, Tomaras AP, Young JA, Zaniewski RP, Shanmugasundaram V, Han S
J Med Chem 57 3845-55 (2014)
PMID: 24694215

Function and Biology Details

Biochemical function:
Biological process:
Cellular component:
Sequence domains:

Structure analysis Details

Assembly composition:
monomeric (preferred)
Assembly name:
PDBe Complex ID:
PDB-CPX-164950 (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
Cell division protein FtsI [Peptidoglycan synthetase] Chain: A
Molecule details ›
Chain: A
Length: 538 amino acids
Theoretical weight: 58.33 KDa
Source organism: Pseudomonas aeruginosa PA1R
Expression system: Escherichia coli
Structure domains:

Ligands and Environments

1 bound ligand:
Ligand 2U3 1 x 2U3
No modified residues

Experiments and Validation Details

Entry percentile scores
X-ray source: APS BEAMLINE 17-ID
Spacegroup: P212121
Unit cell:
a: 67.66Å b: 82.82Å c: 88.31Å
α: 90° β: 90° γ: 90°
R-values:
R R work R free
0.189 0.187 0.225
Expression system: Escherichia coli

Quick links

Citations

9 review citations

New antibiotics from Nature's chemical inventory.
Wencewicz TA. (2016)
8 more

1 mention without citation

Targeting Antibiotic Resistance.
Chellat et al. (2016)