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Structure paper

TitleTrypanosomal Phosphodiesterase B1 and B2 as a Potential Therapy for Human African Trypanosomiasis
Journal, issue, pagesTo Be Published
Publish dateOct 17, 2016 (structure data deposition date)
AuthorsNg, P.S. / Noble, C.G. / Ng, F.S.B. / Chew, S.H. / Lim, C.C. / Manoharan, V. / Wan, K.F. / Vachaspati, P. / Kaiser, M. / Ma, N.L. ...Ng, P.S. / Noble, C.G. / Ng, F.S.B. / Chew, S.H. / Lim, C.C. / Manoharan, V. / Wan, K.F. / Vachaspati, P. / Kaiser, M. / Ma, N.L. / Gedeck, P. / Kounde, C. / Rao, S.P.S.
External linksSearch PubMed
MethodsX-ray diffraction
Resolution1.66 - 1.8 Å
Structure data

PDB-5h2q:
Crystal structure of T brucei phosphodiesterase B2 bound to compound 13e
Method: X-RAY DIFFRACTION / Resolution: 1.66 Å

PDB-5h2r:
Crystal structure of T brucei phosphodiesterase B2 bound to compound 15b
Method: X-RAY DIFFRACTION / Resolution: 1.8 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-MG:
Unknown entry

ChemComp-LLI:
(4~{a}~{S},8~{a}~{R})-2-cycloheptyl-4-[4-methoxy-3-[2-(2-oxidanylideneimidazolidin-1-yl)ethoxy]phenyl]-4~{a},5,8,8~{a}-tetrahydrophthalazin-1-one

ChemComp-HOH:
WATER

ChemComp-LLN:
(4~{a}~{S},8~{a}~{R})-2-cycloheptyl-4-[4-(2-hydroxyethyloxy)-3-[2-(2-oxidanylideneimidazolidin-1-yl)ethoxy]phenyl]-4~{a},5,8,8~{a}-tetrahydrophthalazin-1-one

Source
  • trypanosoma brucei brucei (eukaryote)
KeywordsHYDROLASE / Phosphodiesterase Inhibitor / Trypanosoma brucei / Phosphodiesterase Inhibitor Trypanosoma brucei

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