2F9I

Crystal Structure of the carboxyltransferase subunit of ACC from Staphylococcus aureus


Experimental Data Snapshot

  • Method: X-RAY DIFFRACTION
  • Resolution: 1.98 Å
  • R-Value Free: 0.213 
  • R-Value Work: 0.186 
  • R-Value Observed: 0.189 

wwPDB Validation   3D Report Full Report


This is version 1.5 of the entry. See complete history


Literature

The structure of the carboxyltransferase component of acetyl-coA carboxylase reveals a zinc-binding motif unique to the bacterial enzyme.

Bilder, P.Lightle, S.Bainbridge, G.Ohren, J.Finzel, B.Sun, F.Holley, S.Al-Kassim, L.Spessard, C.Melnick, M.Newcomer, M.Waldrop, G.L.

(2006) Biochemistry 45: 1712-1722

  • DOI: https://doi.org/10.1021/bi0520479
  • Primary Citation of Related Structures:  
    2F9I, 2F9Y

  • PubMed Abstract: 

    Acetyl-coA carboxylase (ACC) is a central metabolic enzyme that catalyzes the committed step in fatty acid biosynthesis: biotin-dependent conversion of acetyl-coA to malonyl-coA. The bacterial carboxyltransferase (CT) subunit of ACC is a target for the design of novel therapeutics that combat severe, hospital-acquired infections resistant to the established classes of frontline antimicrobials. Here, we present the structures of the bacterial CT subunits from two prevalent nosocomial pathogens, Staphylococcus aureus and Escherichia coli, at a resolution of 2.0 and 3.0 A, respectively. Both structures reveal a small, independent zinc-binding domain that lacks a complement in the primary sequence or structure of the eukaryotic homologue.


  • Organizational Affiliation

    Department of Biochemistry, Vanderbilt University School of Medicine, Nashville, Tennessee 37232, USA.


Macromolecules
Find similar proteins by:  (by identity cutoff)  |  3D Structure
Entity ID: 1
MoleculeChains Sequence LengthOrganismDetailsImage
acetyl-coenzyme A carboxylase carboxyl transferase subunit alpha
A, C
327Staphylococcus aureusMutation(s): 0 
Gene Names: ACCAACCD
UniProt
Find proteins for Q2FG38 (Staphylococcus aureus (strain USA300))
Explore Q2FG38 
Go to UniProtKB:  Q2FG38
Entity Groups  
Sequence Clusters30% Identity50% Identity70% Identity90% Identity95% Identity100% Identity
UniProt GroupQ2FG38
Sequence Annotations
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  • Reference Sequence
Find similar proteins by:  (by identity cutoff)  |  3D Structure
Entity ID: 2
MoleculeChains Sequence LengthOrganismDetailsImage
acetyl-coenzyme A carboxylase carboxyl transferase subunit beta
B, D
285Staphylococcus aureusMutation(s): 0 
UniProt
Find proteins for Q5HF73 (Staphylococcus aureus (strain COL))
Explore Q5HF73 
Go to UniProtKB:  Q5HF73
Entity Groups  
Sequence Clusters30% Identity50% Identity70% Identity90% Identity95% Identity100% Identity
UniProt GroupQ5HF73
Sequence Annotations
Expand
  • Reference Sequence
Experimental Data & Validation

Experimental Data

  • Method: X-RAY DIFFRACTION
  • Resolution: 1.98 Å
  • R-Value Free: 0.213 
  • R-Value Work: 0.186 
  • R-Value Observed: 0.189 
  • Space Group: C 1 2 1
Unit Cell:
Length ( Å )Angle ( ˚ )
a = 190.979α = 90
b = 50.859β = 113.51
c = 149.639γ = 90
Software Package:
Software NamePurpose
REFMACrefinement
SCALEPACKdata scaling
CNSrefinement
DMphasing
DENZOdata reduction
PDB_EXTRACTdata extraction
MAR345data collection
CNSphasing

Structure Validation

View Full Validation Report



Entry History 

Deposition Data

  • Released Date: 2006-12-05 
  • Deposition Author(s): Bilder, P.W.

Revision History  (Full details and data files)

  • Version 1.0: 2006-12-05
    Type: Initial release
  • Version 1.1: 2008-05-01
    Changes: Version format compliance
  • Version 1.2: 2011-07-13
    Changes: Version format compliance
  • Version 1.3: 2017-10-18
    Changes: Advisory, Refinement description
  • Version 1.4: 2019-07-24
    Changes: Data collection, Refinement description
  • Version 1.5: 2023-08-30
    Changes: Advisory, Data collection, Database references, Derived calculations, Refinement description