› 6q9n

X-ray diffraction
2.5Å resolution

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-101921 (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
Penicillin binding protein 2 prime Chains: A, B
Molecule details ›
Chains: A, B
Length: 642 amino acids
Theoretical weight: 73.29 KDa
Source organism: Staphylococcus aureus subsp. aureus Mu50
Expression system: Escherichia coli BL21(DE3)
UniProt:
  • Canonical: A0A0H3JPA5 (Residues: 27-668; Coverage: 96%)
Gene names: SAV0041, mecA
Sequence domains:

Ligands and Environments

5 bound ligands:
Ligand QLN 1 x QLN
Ligand JPP 1 x JPP
Ligand CL 4 x CL
Ligand CD 4 x CD
Ligand MUR 1 x MUR
No modified residues

Experiments and Validation Details

Entry percentile scores
X-ray source: ALBA BEAMLINE XALOC
Spacegroup: P212121
Unit cell:
a: 81.17Å b: 102.876Å c: 187.367Å
α: 90° β: 90° γ: 90°
R-values:
R R work R free
0.224 0.221 0.286
Expression system: Escherichia coli BL21(DE3)

Quick links

Citations

7 review citations

β-Lactams against the Fortress of the Gram-Positive Staphylococcus aureus Bacterium.
Fisher et al. (2021)
6 more

5 mentions without citation

A Review on Five and Six-Membered Heterocyclic Compounds Targeting the Penicillin-Binding Protein 2 (PBP2A) of Methicillin-Resistant Staphylococcus aureus (MRSA).
Ambade et al. (2023)
4 more