2Y2K

PENICILLIN-BINDING PROTEIN 1B (PBP-1B) IN COMPLEX WITH AN ALKYL BORONATE (ZA5)

Summary for 2Y2K

Related2Y2I 2UWX 2Y2G 2Y2H 2Y2O 2Y2N 2Y2J 2XD1 2Y2M 2Y2Q 2Y2P 2Y2L 2XD5
DescriptorPENICILLIN-BINDING PROTEIN 1B, [(2,6-DIFLUOROPHENYL)CARBONYLAMINO]METHYL-TRIHYDROXY-BORON, SULFATE ION, ... (7 entities in total)
Functional Keywordstransferase, infection, cell wall, peptidoglycan, inhibitor
Biological sourceSTREPTOCOCCUS PNEUMONIAE
Total number of polymer chains1
Total molecular weight55112.7
Authors
Contreras-Martel, C.,Amoroso, A.,Woon, E.,Zervosen, A.,Inglis, S.,Martins, A.,Verlaine, O.,Rydzik, A.,Job, V.,Luxen, A.,Joris, B.,Schofield, C.,Dessen, A. (deposition date: 2010-12-15, release date: 2011-08-03, Last modification date: 2012-11-14)
Primary citation
Contreras-Martel, C.,Amoroso, A.,Woon, E.C.,Zervosen, A.,Inglis, S.,Martins, A.,Verlaine, O.,Rydzik, A.,Job, V.,Luxen, A.,Joris, B.,Schofield, C.J.,Dessen, A.
Structure-Guided Design of Cell Wall Biosynthesis Inhibitors that Overcome Beta-Lactam Resistance in Staphylococcus Aureus (Mrsa).
Acs Chem.Biol, 6:943-, 2011
PubMed: 21732689 (PDB entries with the same primary citation)
DOI: 10.1021/CB2001846
MImport into Mendeley
Experimental method
X-RAY DIFFRACTION (2.09 Å)
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Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers0.26490.6%6.2%6.6%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution