PMID- 26692420 OWN - NLM STAT- MEDLINE DCOM- 20161021 LR - 20190109 IS - 1521-3773 (Electronic) IS - 1433-7851 (Print) IS - 1433-7851 (Linking) VI - 55 IP - 5 DP - 2016 Jan 26 TI - Programming A Molecular Relay for Ultrasensitive Biodetection through (129)Xe NMR. PG - 1733-6 LID - 10.1002/anie.201508990 [doi] AB - A supramolecular strategy for detecting specific proteins in complex media by using hyperpolarized (129) Xe NMR is reported. A cucurbit[6]uril (CB[6])-based molecular relay was programmed for three sequential equilibrium conditions by designing a two-faced guest (TFG) that initially binds CB[6] and blocks the CB[6]-Xe interaction. The protein analyte recruits the TFG and frees CB[6] for Xe binding. TFGs containing CB[6]- and carbonic anhydrase II (CAII)-binding domains were synthesized in one or two steps. X-ray crystallography confirmed TFG binding to Zn(2+) in the deep CAII active-site cleft, which precludes simultaneous CB[6] binding. The molecular relay was reprogrammed to detect avidin by using a different TFG. Finally, Xe binding by CB[6] was detected in buffer and in E. coli cultures expressing CAII through ultrasensitive (129) Xe NMR spectroscopy. CI - (c) 2016 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim. FAU - Wang, Yanfei AU - Wang Y AUID- ORCID: 0000-0002-9358-4759 AD - Department of Chemistry, University of Pennsylvania, 231 South 34th Street, Philadelphia, PA, 19104-6323, USA. FAU - Roose, Benjamin W AU - Roose BW AUID- ORCID: 0000-0003-3333-5053 AD - Department of Chemistry, University of Pennsylvania, 231 South 34th Street, Philadelphia, PA, 19104-6323, USA. FAU - Philbin, John P AU - Philbin JP AD - Department of Chemistry, University of Pennsylvania, 231 South 34th Street, Philadelphia, PA, 19104-6323, USA. FAU - Doman, Jordan L AU - Doman JL AD - Department of Chemistry, University of Pennsylvania, 231 South 34th Street, Philadelphia, PA, 19104-6323, USA. FAU - Dmochowski, Ivan J AU - Dmochowski IJ AUID- ORCID: 0000-0001-7162-1347 AD - Department of Chemistry, University of Pennsylvania, 231 South 34th Street, Philadelphia, PA, 19104-6323, USA. ivandmo@sas.upenn.edu. LA - eng GR - R01 GM097478/GM/NIGMS NIH HHS/United States GR - T32 GM008275/GM/NIGMS NIH HHS/United States GR - R01-GM097478/GM/NIGMS NIH HHS/United States GR - S10-DO016260/PHS HHS/International GR - P41 GM103403/GM/NIGMS NIH HHS/United States PT - Journal Article PT - Research Support, N.I.H., Extramural PT - Research Support, U.S. Gov't, Non-P.H.S. DEP - 20151221 PL - Germany TA - Angew Chem Int Ed Engl JT - Angewandte Chemie (International ed. in English) JID - 0370543 RN - 3H3U766W84 (Xenon) SB - IM EIN - Angew Chem Int Ed Engl. 2016 Oct 10;55(42):12942. PMID: 27709821 MH - Crystallography, X-Ray MH - Limit of Detection MH - Magnetic Resonance Spectroscopy/*methods MH - Xenon/*chemistry PMC - PMC4902157 MID - NIHMS765627 OTO - NOTNLM OT - NMR spectroscopy OT - bioinorganic chemistry OT - biosensors OT - host-guest systems OT - molecular recognition EDAT- 2015/12/23 06:00 MHDA- 2016/10/22 06:00 PMCR- 2017/01/26 CRDT- 2015/12/23 06:00 PHST- 2015/09/25 00:00 [received] PHST- 2015/12/23 06:00 [entrez] PHST- 2015/12/23 06:00 [pubmed] PHST- 2016/10/22 06:00 [medline] PHST- 2017/01/26 00:00 [pmc-release] AID - 10.1002/anie.201508990 [doi] PST - ppublish SO - Angew Chem Int Ed Engl. 2016 Jan 26;55(5):1733-6. doi: 10.1002/anie.201508990. Epub 2015 Dec 21.