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4-Chlorobenzoyl-CoA Ligase/Synthetase in the Thioester-forming Conformation, bound to 4-chlorophenacyl-CoA

X-ray diffraction
2Å resolution
PDB entry 3cw9 coloured by chain, front view.
PDB entry 3cw9 coloured by chain, side view.
PDB entry 3cw9 coloured by chain, top view.
Source organism: Alcaligenes sp. AL3007
Assembly composition:
homo dimer (preferred)
Entry contents: 1 distinct polypeptide molecule

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Assemblies

Assembly 1 (preferred)
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Assembly Name: 4-chlorobenzoyl CoA ligase
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Multimeric state: homo dimer
Accessible surface area: 37423.18 Å2
Buried surface area: 5267.72 Å2
Dissociation area: 1,371.07 Å2
Dissociation energy (ΔGdiss): -1.3 kcal/mol
Dissociation entropy (TΔSdiss): 14.68 kcal/mol
Symmetry number: 2
PDBe Complex ID: PDB-CPX-184544

Macromolecules

4-chlorobenzoyl CoA ligase
Chains: A, B
Length: 504 amino acids
Theoretical weight: 54.38 KDa
Source organism: Alcaligenes sp. AL3007
Expression system: Escherichia coli
UniProt:
  • Canonical: Q8GN86 (Residues: 1-504; Coverage: 100%)
Pfam:
InterPro:
CATH:
SCOP: Acetyl-CoA synthetase-like
4-chlorobenzoyl CoA ligase in PDB entry 3cw9, assembly 1, front view.
4-chlorobenzoyl CoA ligase in PDB entry 3cw9, assembly 1, side view.
4-chlorobenzoyl CoA ligase in PDB entry 3cw9, assembly 1, top view.
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