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Literature summary for 2.5.1.86 extracted from

  • Chan, H.C.; Feng, X.; Ko, T.P.; Huang, C.H.; Hu, Y.; Zheng, Y.; Bogue, S.; Nakano, C.; Hoshino, T.; Zhang, L.; Lv, P.; Liu, W.; Crick, D.C.; Liang, P.H.; Wang, A.H.; Oldfield, E.; Guo, R.T.
    Structure and inhibition of tuberculosinol synthase and decaprenyl diphosphate synthase from Mycobacterium tuberculosis (2014), J. Am. Chem. Soc., 136, 2892-2896.
    View publication on PubMedView publication on EuropePMC

Application

Application Comment Organism
drug development the enzyme is a target for development of specific inhibitors for anti-infective therapies that block virulence factor formation, the enzyme is a target in treatment of tuberculosis Mycobacterium tuberculosis

Cloned(Commentary)

Cloned (Comment) Organism
gene Rv2361c, recombinant expression Mycobacterium tuberculosis

Crystallization (Commentary)

Crystallization (Comment) Organism
in complex with BPH-640, hanging drop vapor diffusion method, using Mycobacterium tuberculosis
purified recombinant enzyme in complex with inhibitor BPH-640, X-ray diffraction structure determination and analysis at 1.8-1.9 A resolution Mycobacterium tuberculosis

Inhibitors

Inhibitors Comment Organism Structure
BPH-640 a bisphosphonate inhibitor, three-dimensional structure from crystal structure, dimeric DPPS structure with one bound BPH-640 molecule in each monomer, overview. BPH-640 occupies a dimer interface binding site, sandwiched between residues G77, N78, G79, R80, T83, R89, and R127 of monomer A and residues R292 and F293 of monomer B Mycobacterium tuberculosis

Localization

Localization Comment Organism GeneOntology No. Textmining
cell wall
-
Mycobacterium tuberculosis 5618
-

Metals/Ions

Metals/Ions Comment Organism Structure
Mg2+ required Mycobacterium tuberculosis

Natural Substrates/ Products (Substrates)

Natural Substrates Organism Comment (Nat. Sub.) Natural Products Comment (Nat. Pro.) Rev. Reac.
(2Z,6E)-farnesyl diphosphate + 7 isopentenyl diphosphate Mycobacterium tuberculosis
-
7 diphosphate + trans,octacis-decaprenyl diphosphate
-
?
(2Z,6E)-farnesyl diphosphate + 7 isopentenyl diphosphate Mycobacterium tuberculosis H37Rv
-
7 diphosphate + trans,octacis-decaprenyl diphosphate
-
?
(2Z,6E)-farnesyl diphosphate + isopentenyl diphosphate Mycobacterium tuberculosis
-
diphosphate + trans,octacis-decaprenyl diphosphate
-
?
(2Z,6E)-farnesyl diphosphate + isopentenyl diphosphate Mycobacterium tuberculosis H37Rv
-
diphosphate + trans,octacis-decaprenyl diphosphate
-
?

Organism

Organism UniProt Comment Textmining
Mycobacterium tuberculosis P9WFF7
-
-
Mycobacterium tuberculosis P9WFF7 gene Rv2361c
-
Mycobacterium tuberculosis H37Rv P9WFF7
-
-

Substrates and Products (Substrate)

Substrates Comment Substrates Organism Products Comment (Products) Rev. Reac.
(2Z,6E)-farnesyl diphosphate + 7 isopentenyl diphosphate
-
Mycobacterium tuberculosis 7 diphosphate + trans,octacis-decaprenyl diphosphate
-
?
(2Z,6E)-farnesyl diphosphate + 7 isopentenyl diphosphate the enzyme is a cis-prenyl transferase Mycobacterium tuberculosis 7 diphosphate + trans,octacis-decaprenyl diphosphate
-
?
(2Z,6E)-farnesyl diphosphate + 7 isopentenyl diphosphate
-
Mycobacterium tuberculosis H37Rv 7 diphosphate + trans,octacis-decaprenyl diphosphate
-
?
(2Z,6E)-farnesyl diphosphate + 7 isopentenyl diphosphate the enzyme is a cis-prenyl transferase Mycobacterium tuberculosis H37Rv 7 diphosphate + trans,octacis-decaprenyl diphosphate
-
?
(2Z,6E)-farnesyl diphosphate + isopentenyl diphosphate
-
Mycobacterium tuberculosis diphosphate + trans,octacis-decaprenyl diphosphate
-
?
(2Z,6E)-farnesyl diphosphate + isopentenyl diphosphate
-
Mycobacterium tuberculosis H37Rv diphosphate + trans,octacis-decaprenyl diphosphate
-
?

Subunits

Subunits Comment Organism
dimer
-
Mycobacterium tuberculosis

Synonyms

Synonyms Comment Organism
cis-decaprenyl diphosphate synthase
-
Mycobacterium tuberculosis
decaprenyl diphosphate synthase
-
Mycobacterium tuberculosis
DPPS
-
Mycobacterium tuberculosis
Rv2361c
-
Mycobacterium tuberculosis

IC50 Value

IC50 Value IC50 Value Maximum Comment Organism Inhibitor Structure
0.00041
-
pH and temperature not specified in the publication Mycobacterium tuberculosis BPH-640

General Information

General Information Comment Organism
physiological function the enzyme is involved in cell wall biosynthesis Mycobacterium tuberculosis