31HD

Crystal structure of S. aureus HMG-CoA synthase covalently bound to inhibitor

This is a non-PDB format compatible entry.

Summary for 31HD

• Entry DOI: 10.2210/pdb31hd/pdb
• Descriptor: Hydroxymethylglutaryl-CoA synthase, ~{N}-[[1-(2-methoxydibenzofuran-3-yl)-1,2,3-triazol-4-yl]methyl]ethanamide (3 entities in total)
• Functional Keywords: hmg-coa synthase, transferase, lyase
• Biological source: Staphylococcus aureus
• Total number of polymer chains: 8
• Total formula weight: 354283.04

Authors

Gote, T.A.,van der Voort, S.P.,Overkleeft, H.S.,Hacker, S.M.,Armstrong, Z. (deposition date: 2026-06-04, release date: 2026-11-04)

• Primary citation: van der Voort, S.,Gote, T.,vant Ooster, S.,Gagestein, B.,Florea, B.I.,van den Berg, R.J.B.H.N.,Armstrong, Z.,Overkleeft, H.S.,Hacker, S.M.; A Direct-to-Biology Platform for Rapid Covalent Antibiotic Discovery; Chemrxiv, 2026:-, ; DOI: 10.26434/chemrxiv.15010946/v1

Experimental method

X-RAY DIFFRACTION (2.05 Å)