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TitleHigh Resolution X-Ray Crystal Structures of LmCPB2.8 Co-Crystalized with Dipeptidyl Aza-nitrile Inhibitor and Structure Activity Relationships
Journal, issue, pagesTo Be Published
Publish dateMay 27, 2019 (structure data deposition date)
AuthorsRibeiro, J.F.R. / De Vita, D. / Li, C. / Emsley, J. / Montanari, C.A.
External linksSearch PubMed
MethodsX-ray diffraction
Resolution1.35 Å
Structure data

PDB-6p4e:
Leishmania mexicana CPB in complex with an aza-nitrile inhibitor
Method: X-RAY DIFFRACTION / Resolution: 1.35 Å

Chemicals

ChemComp-NA:
Unknown entry

ChemComp-ACT:
ACETATE ION

ChemComp-MPD:
(4S)-2-METHYL-2,4-PENTANEDIOL / precipitant*YM

ChemComp-GES:
3-tert-butyl-N-[(2S)-1-(2-cyano-1,2-dimethylhydrazinyl)-4-methyl-1-oxopentan-2-yl]-1-methyl-1H-pyrazole-5-carboxamide (non-preferred name)

ChemComp-TRS:
2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL / pH buffer*YM

ChemComp-HOH:
WATER

Source
  • leishmania mexicana (eukaryote)
KeywordsHYDROLASE/HYDROLASE INHIBITOR / endopeptidase / HYDROLASE-HYDROLASE INHIBITOR complex

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