Brand  (β version)

PDB ID: 5NX6

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Ligands
Code Name Style Show Link
9D2 2-ethyl-2-(hydroxymethyl)propane-1,3-diol PoSSuM
GOL Glycerol PoSSuM
LA6 (2e)-2-fluoro-3,7-dimethylocta-2,6-dien-1-yl trihydrogen diphosphate PoSSuM
MG Magnesium ion PoSSuM
NDS Ethyl dimethyl ammonio propane sulfonate PoSSuM
Non-standard Residues
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Structure summary

Code : 5NX6   PDBj   RCSB PDB   PDBe
Header : LYASE
Title : Crystal structure of 1,8-cineole synthase from Streptomyces clavuligerus in complex with 2-fluoroneryl diphosphate
Release Data : 2017-09-20
Compound :
mol_id molecule chains synonym
1 Pentalenene synthase A,B 1,8-cineole synthase
ec: 4.2.3.7
Source :
mol_id organism_scientific expression_system
1 Streptomyces clavuligerus  (taxid:1901) Escherichia coli  (taxid:562)
gene: SCLAV_p0982, SSCG_00536
Authors : Karuppiah, V., Leys, D., Scrutton, N.S.
Keywords : terpene synthase, 1, 8-cineole, monoterpenoid, Eucalyptol, lyase
Exp. method : X-RAY DIFFRACTION ( 1.630 Å )
Citation :

Structural Basis of Catalysis in the Bacterial Monoterpene Synthases Linalool Synthase and 1,8-Cineole Synthase.

Karuppiah, V.,Ranaghan, K.E.,Leferink, N.G.H.  et al.
(2017)  ACS Catal  7 : 6268 - 6282

PubMed: 28966840
DOI: 10.1021/acscatal.7b01924

Reaction

Chain : A, B
UniProt : B5GMG2 (CNSA_STRCL)
Reaction: EC: Evidence:
Physiological Direction:
(2E)-geranyl diphosphate + H2O = 1,8-cineole + diphosphate 4.2.3.108 PubMed:21726035, PubMed:28144299, PubMed:28966840
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H2O + neryl diphosphate = 1,8-cineole + diphosphate - PubMed:28966840
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