Brand  (β version)

PDB ID: 3TFP

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Ligands
Code Name Style Show Link
03L 2-({2-chloro-6-[(2,4-dichlorophenyl)sulfanyl]benzyl}carbamoyl)benzoic acid PoSSuM
MG Magnesium ion PoSSuM
Non-standard Residues
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Structure summary

Code : 3TFP   PDBj   RCSB PDB   PDBe
Header : TRANSFERASE/transferase inhibitor
Title : Crystal Structure of Dehydrosqualene Synthase (CrtM) from S. aureus Complexed with BPH-1162
Release Data : 2012-04-04
Compound :
mol_id molecule chains synonym
1 Dehydrosqualene synthase A 4,4'-diapophytoene synthase, DAP synthase, Diapophytoene synthase
ec: 2.5.1.-
Source :
mol_id organism_scientific expression_system
1 Staphylococcus aureus  (taxid:1280) Escherichia coli  (taxid:511693)
gene: crtM
expression_system_vector_type: plasmid
expression_system_plasmid: pET32-LIC
Authors : Lin, F.-Y., Liu, Y.-L., Zhang, Y., Oldfield, E.
Keywords : Head-to-Head Prenyl Synthase, TRANSFERASE-transferase inhibitor complex
Exp. method : X-RAY DIFFRACTION ( 2.000 Å )
Citation :

Dual dehydrosqualene/squalene synthase inhibitors: leads for innate immune system-based therapeutics.

Lin, F.Y.,Zhang, Y.,Hensler, M.  et al.
(2012)  Chemmedchem  7 : 561 - 564

PubMed: 22290830
DOI: 10.1002/cmdc.201100589

Reaction

Chain : A
UniProt : A9JQL9 (CRTM_STAAU)
Reaction: EC: Evidence:
Physiological Direction:
2 (2E,6E)-farnesyl diphosphate = 15-cis-4,4'-diapophytoene + 2 diphosphate 2.5.1.96 PubMed:18276850
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