2XVN

A. fumigatus chitinase A1 phenyl-methylguanylurea complex

Summary for 2XVN

Related2XUC 2XVP
DescriptorASPERGILLUS FUMIGATUS CHITINASE A1, 1-METHYL-3-(N-PHENYLCARBAMIMIDOYL)UREA, CHLORIDE ION, ... (4 entities in total)
Functional Keywordshydrolase, inhibitor
Biological sourceASPERGILLUS FUMIGATUS
Total number of polymer chains3
Total molecular weight102274.54
Authors
Rush, C.L.,Schuttelkopf, A.W.,Hurtado-Guerrero, R.,Blair, D.E.,Ibrahim, A.F.M.,Desvergnes, S.,Eggleston, I.M.,van Aalten, D.M.F. (deposition date: 2010-10-26, release date: 2010-11-03, Last modification date: 2011-07-13)
Primary citation
Rush, C.L.,Schuttelkopf, A.W.,Hurtado-Guerrero, R.,Blair, D.E.,Ibrahim, A.F.M.,Desvergnes, S.,Eggleston, I.M.,Van Aalten, D.M.F.
Natural Product-Guided Discovery of a Fungal Chitinase Inhibitor.
Chem.Biol., 17:1275-, 2010
PubMed: 21168763 (PDB entries with the same primary citation)
DOI: 10.1016/J.CHEMBIOL.2010.07.018
MImport into Mendeley
Experimental method
X-RAY DIFFRACTION (2.35 Å)
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Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers0.269272.0%7.7%11.8%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution