Crystal Structure of Polyneuridine Aldehyde Esterase Complexed with 16-epi-Vellosimine

Summary for 3GZJ

DescriptorPolyneuridine-aldehyde esterase, 16-epi-Vellosimine (3 entities in total)
Functional Keywordshydrolase superfamily, alkaloid metabolism, hydrolase, serine esterase
Biological sourceRauvolfia serpentina (devilpepper)
Total number of polymer chains5
Total molecular weight146227.65
Yang, L.,Hill, M.,Wang, M.,Panjikar, S.,Stoeckigt, J. (deposition date: 2009-04-07, release date: 2009-08-18, Last modification date: 2017-11-01)
Primary citation
Yang, L.,Hill, M.,Wang, M.,Panjikar, S.,Stockigt, J.
Structural basis and enzymatic mechanism of the biosynthesis of C9- from C10-monoterpenoid indole alkaloids
Angew.Chem.Int.Ed.Engl., 48:5211-5213, 2009
PubMed: 19496101 (PDB entries with the same primary citation)
DOI: 10.1002/anie.200900150
MImport into Mendeley
Experimental method

Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers0.289120.4%4.3%6.6%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution