SCIENTIFIC SCHOOL
NMR IN DRUG DISCOVERY
Data: 22-24 settembre 2025
Presentazione Corso
Il corso di alta formazione “NMR IN DRUG DISCOVERY“, organizzato da Sardegna Ricerche e Porto Conte Ricerche, con il Patrocinio del Gruppo Italiano Discussione Risonanze Magnetiche (GIDRM) si propone di fornire una solida introduzione teorico-pratica all’uso della spettroscopia di Risonanza Magnetica Nucleare (NMR) con particolare riferimento alle applicazioni per lo studio delle interazioni biomolecolari in ambito drug discovery.
L’iniziativa nasce dalla collaborazione tra le due sedi del parco scientifico e tecnologico della Sardegna, Pula e Alghero, nell’ambito di un progetto volto all’integrazione delle piattaforme di Risonanza Magnetica Nucleare.
Competenze specialistiche nei settori più tecnologici, come la gestione di strumentazione avanzata quale la spettroscopia NMR ad alta risoluzione applicata allo studio di sistemi biologici e impiegata in numerosi settori della ricerca scientifica, sono fondamentali nella creazione di nuove figure professionali strategiche e immediatamente operative, oggi estremamente richieste nei settori biotech, pharma e ricerca strutturale.
Programma
Questa scuola scientifica offre un’occasione formativa stimolante, pensata per introdurre i partecipanti alla tecnica NMR nello studio dei sistemi biologici.
Attraverso un percorso teorico-pratico ben strutturato, la scuola guida dalla comprensione dei principi fondamentali fino alle prime applicazioni strumentali, con particolare attenzione alla caratterizzazione delle macromolecole proteiche e delle loro interazioni con molecole a basso peso molecolare, come metaboliti, farmaci e altri ligandi.
Le competenze sviluppate spaziano dalla comprensione dei fenomeni fisici alla base della risonanza magnetica nucleare, alla conoscenza dei principali componenti hardware e software dello spettrometro, fino all’impiego delle sequenze NMR necessarie per visualizzare strutture, caratterizzare meccanismi e analizzare le dinamiche di interazione.
Il percorso include inoltre una solida introduzione agli step di acquisizione ed elaborazione dei dati mono- e multidimensionali, fino ad arrivare ad applicazioni pratiche nello studio delle interazioni molecolari.
22 settembre - Giorno 1 - Introduzione sulla spettroscopia NMR in drug discovery
- 08:45 Accoglienza e regitrazione dei partecipanti
- 10:00 Introduzione al Corso
- 10:15 Principi generali della spettroscopia di Risonanza Magnetica Nucleare (momento angolare di spin, momento magnetico, magnetizzazione macroscopica, livelli energetici); parametri NMR (chemical shift, larghezza di riga, area del segnale, accoppiamento scalare) Daniel Oscar Cicero – Università Tor Vergata Roma
- 11:45 Pausa caffè
- 12:15 Il rilassamento nucleare: l’effetto Overhauser nucleare (NOE). – La spettroscopia NMR multidimensionale Daniel Oscar Cicero – Università Tor Vergata Roma
- 13:00 Light Lunch
- 14:00 Caratterizzazione NMR di piccole molecole: esperimenti 1D e 2D necessari e strategie per l’assegnazione e interpretazione degli spettri Alfonso Mangoni – Università degli Studi di Napoli “Federico II”
- 15:30 Pausa caffè
- 16:00 Uso della spettroscopia NMR per lo studio di piccole molecole in soluzione: esempi pratici Alfonso Mangoni – Università degli Studi di Napoli “Federico II”
- 17:00 Discussione
- 19:00 Aperitivo sociale
23 settembre - Giorno 2 - Ligand-observed binding experiments
- 09:15 Principi della spettroscopia NMR per la caratterizzazione delle interazioni molecolari e introduzione allo studio delle interazioni proteina-ligando mediante esperimenti NMR ligand-observed: Transfered NOE (TrNOE); Saturation Transfer Difference (STD-NMR), (WaterLOGSY), coefficienti di diffusione, teoria ed esempi Cristina Airoldi – Università degli Studi Milano Bicocca
- 11:00 Pausa caffè
- 11:30 Esperimenti ligand-based in condizioni “non-convenzionali”: screening di miscele complesse; on-cell STD NMR. Cristina Airoldi – Università degli Studi Milano Bicocca
- 12:30 Light lunch
- 13:30 Settaggio degli esperimenti NMR per la caratterizzazione di piccole molecole Francesca Benevelli (BRUKER)
- 15:30 Pausa caffè
- 16:00 Acquisizione esperimenti basati sulle metodologie Ligand observed Francesca Benevelli (BRUKER)
- 17:00 Discussione
24 settembre - Giorno 3 - Protein-observed binding: struttura tridimensionale delle proteine
- 09:15 Applicazioni NMR per lo studio delle interazioni proteina-ligando mediante esperimenti protein-observed Luigi Russo – Università degli Studi della Campania “Luigi Vanvitelli”
- 11:00 Pausa caffè
- 11:30 Metodologie NMR per lo studio di proteine ad alto peso molecolare Angelo Gallo – Università degli Studi di Torino
- 13:00 Light lunch
- 14:00 Applicazioni 19F NMR per lo studio delle interazioni molecolari (es. interazione con metalli, interazione proteina-proteina, equilibri conformazionali) Luigi Russo – Università degli Studi della Campania “Luigi Vanvitelli”
- 15:30 Pausa caffè
- 16:00 Approcci integrati basati sull’utilizzo di metodi computazionali (es.AlphaFold) e parametri NMR (RDCs, chemical Shifts, NOEs) Gianluca D’Abrosca Link Campus – University, Roma – Università degli Studi della Campania “Luigi Vanvitelli”
- 17:00 Sessione di confronto e domande aperte con i docenti
- 17:30 Conclusione della scuola
Relatori
DANIEL OSCAR CICERO - Curriculum Vitae
Personal Information
Associate Professor, Department of Chemical Science and Technologies, University of Rome “Tor Vergata”, Italy
Email: cicero@scienze.uniroma2.it
Education
Ph.D. in Chemistry, University of Buenos Aires, Argentina (1990)
Licenciado en Ciencias Químicas, University of Buenos Aires, Argentina (1985)
Professional and Academic Experience
2004–present: Associate Professor, University of Rome “Tor Vergata”
1992–2001: Research Fellow, Merck Research Laboratories–IRBM, Pomezia, Italy
1990–1992: Postdoctoral Fellow, Merck Research Laboratories–IRBM
2010–2012: Director, NMR Laboratory, Fundación Instituto Leloir, Buenos Aires Scientific Consultant roles: Merck Serono, Bridgestone, IRBM S.p.A., C4T
Contributions to Science
• Synthesis of modified carbohydrates and nucleosides for drug discovery, including antisense DNA molecules.
• Structural studies of proteins and complexes relevant to antiviral drug design, including the HCV NS3 protease and HPV E2 regulator.
• Development of NMR conformational analysis methods, notably NAMFIS.
• Metabolomics research leading to biomarkers for bladder and prostate cancer and cardiovascular diseases.
Selected Publications
• 145 ISI peer-reviewed articles; H-index (Scopus): 28; Total citations: 2706
• Metabolic Crosstalk in Multimorbidity: Identifying Compensatory Effects Among Diabetes, Hypertension, and Dyslipidemia. E. Pitti, D. Vanni, N. Viceconte, A. Lembo, G. Tanzilli, V. Raparelli, G. Petrella, D.O. Cicero. J Endocr Soc. Sep 11;8(10) (2024).
• Urinary metabolic markers of bladder cancer: a reflection of the tumor or response of the body? G. Petrella, G. Ciufolini, R. Vago, D.O. Cicero. Metabolites, 11, 756 (2021).
• Personalized metabolic profile by synergic use of NMR and HRMS. G. Petrella, C. Montesano, S. Lentini, G. Ciufolini, D. Vanni, R. Speziale, A. Salonia, F. Montorsi, V. Summa, R. Vago, L. Orsatti, E. Monteagudo, D.O. Cicero. Molecules, 26, 4167 (2021).
• Jogalekar AS, Kriel FH, Shi Q, Cornett B, Cicero D.O., Snyder JP. “The discodermolide hairpin structure flows from conformationally stable modular motifs.” Journal of Medicinal Chemistry, 53, 155–165 (2010)
• Thepchatri P, Eliseo T, Cicero D.O., Myles D, Snyder JP. “Relationship among ligand conformations in solution, in the solid state, and at the Hsp90 binding site: geldanamycin and radicicol.” Journal of the American Chemical Society, 129, 3127–3134 (2007)
• Monteagudo E, Cicero D.O., Cornett B, Myles DC, Snyder JP. “The conformations of Discodermolide in DMSO.” Journal of the American Chemical Society, 123, 6929–6930 (2001)
• Barbato G, Cicero D.O., Cordier F, Narjes F, Gerlach B, Sambucini S, Grzesiek S, Matassa VG, De Francesco R, Bazzo R. “Inhibitor binding induces active site stabilisation of the HCV NS3 protein serine protease domain.” EMBO Journal, 19, 1195–1206 (2000)
• Cicero D.O., Barbato G, Bazzo R. “NMR analysis of molecular flexibility in solution (NAMFIS): a new method for the study of complex distributions of rapidly exchanging conformations. Application to a 13-residue peptide with an 8 residue loop.” Journal of the American Chemical Society, 117, 1027–1033 (1995)
Awards
2025: GIDRM/GIRM Gold Medal, Gruppo Italiano Risonanze Magnetiche and Italian Chemical Society
ALFONSO MANGONI - Curriculum Vitae
Università degli Studi di Napoli “Federico II”
Current Position:
Professor of Organic Chemistry
University of Napoli Federico II (Italy)
Dipartimento di Farmacia , Via D. Montesano 49, 80131 Napoli, Italy
Email alfonso.mangoni@unina.it
Citizenship
Italy
Metrics overview (Scopus, as of 01.09.2025)
Papers: 143
H-index: 35
Citations: 3901
Education
21/7/1988: Degree in Chemistry, University of Napoli Federico II, top marks with honors
6/1987–7/1988: Undergraduate student at University of Naples Federico II, Dipartimento di Chimica delle Sostanze Naturali
7/1988–3/1990: Graduate student at University of Naples Federico II, Dipartimento di Chimica delle Sostanze Naturali
Visiting Professorships
6/1995–9/1995: Columbia University (New York, NY, USA), Prof. Koji Nakanishi
2/2006–8/2006: University of California San Diego/Scripps Institution of Oceanography (San Diego, CA, USA), Prof. William Gerwick.
Positions
11/2002–present: Professor of Organic Chemistry at University of Naples Federico II, Dipartimento di Farmacia
11/1998–10/2002: Associate Professor of Organic Chemistry at University of Naples Federico II, Dipartimento di Chimica delle Sostanze Naturali.
3/1990–10/1998: Assistant Professor of Organic Chemistry at University of Naples Federico II, Dipartimento di Chimica delle Sostanze Naturali.
Academic Offices
7/2010–12/2012: Director of Dipartimento di Chimica delle Sostanze Naturali, University of Naples Federico II.
11/2007–12/2013: Director of CSIAS (Interdepartmental Service Center for Spectroscopic Analysis), University of Napoli “Federico II.
Teaching
Courses given (Pharmaceutical Chemistry program): Organic Chemistry, Organic Spectroscopy, Bioorganic Chemistry, Molecular Modeling, General Chemistry
Supervised PhD students: 11 PhD students as for 2025
EU Funded Research Projects
BlueGenics – From gene to bioactive product: Exploiting marine genomics for an innovative and sustainable European blue biotechnology industry, FP7-KBBE-2012-6-singlestage Project No. 311848 (2012–2016) – € 588.610 – Coordinator for University of Naples and WP leader
MarBioTec*EU-CN* – European-Chinese Research Staff Exchange on Marine Biotechnology, FP7-PEOPLE-2009-IRSES Project No. 246987 (2010-2014) – € 75.600 – Coordinator for University of Naples
NatPharma – Reinforcement of research potential for the realisation of a complete drug development scheme from natural compounds, REGPOT-2008-1 Project No. 229893 (2009-2011) – € 809.710 – WP Leader
National Research Projects
FARMABIONET – Rete integrata per le Biotecnologie applicate a molecole ad attività Farmacologica, CUP B25C13000230007, Regione Campania, P.O. FESR Campania 2007-2013, Obiettivo Operativo 2.1 (2013–2015) – € 634.145 – Scientific coordinator of the project
PRIN2004, “Glicolipidi bioattivi da organismi marini”, Project No. 200403371, local coordinator
PRIN2002, “Glicolipidi bioattivi da organismi marini”, Project No. 2002034581, local coordinator
Other Experience and Professional Memberships
2001-present: Member, Società Chimica Italiana
2016-present: Member, American Chemical Society
Scientific activity
The main focus of my research on marine natural products is the chemistry of marine macroorganisms (with emphasis on Porifera) and microorganisms, including isolation, structure elucidation, and bioactivity. Starting from this topic, my research developed in several directions: development and use of new methods for dereplication of natural extracts; development and use of new methods for structural elucidation of organic compounds; biosynthetic studies on
natural products from microbial symbionts of marine organisms; and total synthesis of analogues of marine natural products. This research has led to the publication of 143 papers in peer-reviewed international journals.
Development and use of spectroscopic and computational methods for structural elucidation. The complex structures of many natural products required the use of the most advanced spectroscopic techniques currently available, as well as improvements to existing methods. Computational prediction of NMR parameters and chiroptical properties through DFT calculations has recently become an important approach for structure elucidation and validation. These
computational methods are being used increasingly in my research, with state-of-the-art protocols applied and new ones developed.
Dereplication of natural extracts and molecular networking. In modern natural product discovery pipelines, great attention is paid to dereplication—the early identification of known compounds. An innovative dereplication scheme based on molecular networking of liquid chromatography/tandem mass spectrometry (LC-MS²) data is gaining increasing importance, as molecular networking can assess structural similarities between analyzed compounds in an
automated and untargeted manner. My recent research makes extensive use of these techniques.
Studies on the biosynthesis of natural products from microorganisms, including sponge symbionts. I became interested in the biosynthesis of metabolites found in marine sponges, particularly in the role played by bacterial symbionts. This led to the study of biosynthetic pathways of bacterial metabolites. Two grants obtained from the EC allowed the setup of a microbiology and molecular biology laboratory equipped with state-of-the-art instrumentation. For example, a
novel type I polyketide synthase (PKS) of sponges was first found in the metagenome of Plakortis simplex, and later found to be widespread in sponge metagenomes. Very recently, the biosynthetic gene cluster of the cyclic peptides thermoactinoamides was identified.
Bioactive Secondary Metabolites from Marine Organisms. Isolation and identification of natural products of marine origin has been the core activity of my research throughout my career, with growing interest over the years in the biological and pharmacological activity of the isolated compounds. Many bioactive compounds were discovered by my research group, showing anti-inflammatory, cytotoxic, neurotoxic, and kinase-inhibitory activities. Very recently, we
discovered a series of highly cytotoxic chlorinated peptide/polyketide hybrids from sponges of the genus Smenospongia. The remarkable biological activity of these compounds prompted us to undertake their total synthesis.
Glycolipids from marine sponges: isolation, evaluation of biological activity, and total synthesis. An important part of my research has focused on the isolation, structural elucidation, and biological evaluation of glycolipids from marine sponges. Marine sponges were shown to be an incredibly rich source of new glycolipid structures. We identified many glycosphingolipids, including a whole new class (the α-galactoglycosphingolipids), some interesting glycoglycerolipids, and entirely novel glycolipids such as simplexide. Many of these glycolipids exhibit activity on the immune system.
These studies also led to the development of new, specific procedures for the isolation and purification of glycolipids, as well as new NMR-based methods for elucidating the structure of oligosaccharide chains. In parallel, we performed the total synthesis of analogues of natural α-galactoglycosphingolipids to investigate their structure–activity relationships, contributing to the development of new synthetic methodologies in carbohydrate chemistry.
CRISTINA AIROLDI - Curriculum Vitae
Her first most significant scientific result was the development of a new patented NMR methodology for the characterization of molecular recognition processes by an on-cell approach. The methodology, combining genetic engineering of mammalian cells and STD NMR experiment under HR-MAS conditions, improves the versatility of the STD NMR experiment and expands its use to samples containing living cells deriving from solid tissues. On-cell STD NMR has been applied to different cell lines, both prokaryotic and eukaryotic, and to the study of diverse ligand-receptor systems.
The second most relevant scientific contribution concerns the setup of advanced NMR protocols to study molecular interaction between amyloid peptide oligomers and their inhibitors.
A more recent development of this research field concerns the combination of NMR ligand-receptor interaction studies, and NMR and MS-based metabolomics, for the rapid screening of natural extracts for the presence of amyloid ligands.
Moreover, she manages various industrial collaborations, with pharmaceutical and/or biotech industries, in which she develops methods based on NMR spectroscopy for the study of the mechanisms of action of drugs and bioactive compounds at the molecular level.
Selected publications
1. Airoldi C.,* Giovannardi S., La Ferla B., Jiménez-Barbero J., Nicotra F., Saturation Transfer Difference NMR experiments of membrane proteins in living cells under HR-MAS conditions: The interaction of the SGLT1 cotransporter with its ligands, Chem. Eur. J., 2011, 17, 13395-13399.
2. Sironi E., Colombo L., Lompo A., Messa M., Bonanomi M., Regonesi M. E., Salmona M., Airoldi C.*, Natural compounds against neurodegenerative diseases: molecular characterization of the interaction of catechins from green tea with Aβ1-42, PrP106-126 and ataxin-3 oligomers, Chem. Eur. J., 2014, 20, 13793–13800.
3. Airoldi C.,* Ciaramelli C., Fumagalli M., Bussei R., Mazzoni V., Viglio S., Iadarola P., Stolk J.*, 1H-NMR to explore the metabolome of exhaled breath condensate in α1-antitrypsin deficient patients: a pilot study, J. Proteome Res., 2016, 15, 12, 4569–4578
4. Ciaramelli C., Palmioli A., De Luigi A., Colombo L., Sala G., Riva C., Zoia C. P., Salmona M., Airoldi C.*, NMR-driven identification of anti-amyloidogenic compounds in green and roasted coffee extracts, Food Chemistry 2018, 252, 171-180.
5. Palmioli A., Ceresa C., Tripodi F., La Ferla B., Nicolini G., Airoldi C.*, On-cell saturation transfer difference NMR study of Bombesin binding to GRP receptor, Bioorg. Chem., 2020, 99, 103861.
6. Palmioli A.*, Sperandeo P., Bertuzzi S., Polissi A., Airoldi C.*, On-cell Saturation Transfer Difference NMR for the identification of FimH ligands and inhibitors, Bioorg. Chem., 2021, 112, 104876.
7. Palmioli A., Mazzoni V., De Luigi A., Bruzzone C., Sala G., Colombo L., Bazzini C., Zoia C. P., Inserra M., Salmona M., De Noni I., Ferrarese C., Diomede L., Airoldi C.* Alzheimer’s disease prevention through natural compounds: cell-free, in vitro, and in vivo dissection of hop (Humulus lupulus L.) multitarget activity, ACS Chem. Neurosci. 2022, 13, 22, 3152–3167.
8. Palmioli A., Moretti L., Vezzoni C. A., Legnani L., Sperandeo P., Baldini L., Sansone F., Airoldi C.,* Casnati A.,* Multivalent calix[4]arene-based mannosylated dendrons as new FimH ligands and inhibitors, Bioorganic Chemistry, 2023, 138, 106613.
9. Rispoli F., Moretti L., Vezzoni C. A., Tosi E., Molteni L., Ciaramelli C., Marchiò L., Volpi S., Baldini L., Sansone F., Palmioli A., Airoldi C.,* Casnati A.,* Clustering zwitterionic amino acids at the upper rim of cone calix[4]arene triggers the selective recognition of Gram-negative bacterial envelope, Small Structures, 2025, 6, 6, 2400547
10. Molteni L., Bruzzone C., Ami D., De Luigi A., Colombo L., Moretti L., Natalello A., Palmioli A., Airoldi C.,* Xanthohumol destabilizes the structure of amyloid-β (Aβ) oligomers and promotes the formation of high-molecular-weight amorphous aggregates, International Journal of Biological Macromolecules, 2025, 319, 4, 145720.
FRANCESCA BENEVELLI - Curriculum Vitae
WORK EXPERIENCE
From October 2002 up to now – NMR Application scientist, Bruker Italia , Milano, Italy
▪ Technical support to sales
▪ Demoing SW and HW to customers
▪ Training customers on new applications
▪ Partnering with customers to develop customized solutions
▪ Participating to global R&D project for developing new products, recently in the field of quality control, metabonomic and automation
Business or sector Analytical chemistry, nuclear magnetic resonance
From May 1998 to October 1998 – Solid state NMR facility manager- University of Cambridge, UK
▪ Supporting postdoc and researcher during their NMR experiments
▪ Responsible for the maintenance of the NMR
From January 1996 to May 1998 NMR manager CIGS- Università di Pavia, Pavia, Italy
▪ Supporting postdoc and researcher during their NMR experiments
▪ Responsible for the maintenance of the NMR
EDUCATION AND TRAINING
From November 2001 to October 2002 – Postdoc grant “Hydrogen Bonds and hydrogen transfer” – Freie Universitaet Berlin, Germany
▪ Synthesis and characterization of NAD derivatives
▪ Teaching experience at the bilingual master
From October 1998 to October 2001 – PhD in physical chemistry – University of Cambridge, UK
▪ Management of the solid state NMR laboratory
▪ Grant from ESPRC
From January 1995 to January 1996 – Research Grant – Bracco Imaging
▪ Meaurements of pKa using 13C NMR
From 1989 to 1994 – Degree in chemistry 110/110 cum laude – Università di Pavia, Pavia, Italy
From 1984 to 1989 Maturità scientifica 56/60 – Liceo scientifico “Belfiore”, Mantova, Italy
Papers published in international journal:
• Benevelli, F.; Carugo, O.; Invernizzi, A. G.; Vidari, G., Tetrahedron Letters (1995), Vol. 36, pp. 3035-3038
• Cazzanelli, E.; Mustarelli, P.; Benevelli, F.; Appetecchi, G. B.; Croce, F. Solid State Ionics (1996), Vol.6-8, pp. 379-384
• Cazzanelli, E.; Croce, F.; Appetecchi, G. B.; Benevelli, F.; Mustarelli, P. Journal of Chemical Physics (1997), Vol.107, pp. 5740-5747
• Mustarelli, P.; Quartarone, E.; Benevelli, F., Materials Research Bulletin (1997),Vol. 32, pp. 679-687
• Benevelli, F.; Kolodziejski, W.; Wozniak, K.; Klinowski, J. Chemical Physics Letters (1999), Vol. 308, pp. 65-70
• Collina, S.; Benevelli, F.; Vercesi, D.; Ghislandi, V. Tetrahedron-Asymmetry (1999), Vol. 10, pp. 2387-2397
• Benevelli, F.; Bond, A.; Duer, M.; Klinowski, J. Physical Chemistry Chemical Physics (2000), Vol. 2 , pp. 3977-3981
• Collina, S.; Azzolina, O.; Vercesi, D.; Benevelli, F.; Callegari, A.; Tadini, C.; Lanza, E.; Barbieri, A.Ghislandi, V Bioorganic & Medicinal Chemistry (2000), Vol. 8, pp. 769-775
• Benevelli, F.; Doyle, E. L.; Harron, E. A.; Feeder, N.; Quadrelli, E. A.; Saez, D.; Wright, D.S Angewandte Chemie-International Edition (2000), Vol.39, pp. 1501-1502
• Pietraszkiewicz, M.; Pietraszkiewiez, O.; Kolodziejski, W.; Wozniak, K.; Feeder, N.; Benevelli, F.;Klinowski, J. Journal of Physical Chemistry B (2000), Vol. 104, pp. 1921-1926
• Benevelli, F.; Kolodziejski; W. Wozniak; K. Klinowski J. Physical Chemistry Chemical Physics (2001), Vol.3, 1762-1768
• A.D. Bond, F.Benevelli, W. Jones Journal of Material Chemistry (2002), Vol 12, 324-332
• Francesca Benevelli, Jacek Klinowski, István Bitter, Alajos Grün, Barbara Balázs and Gábor Tóth Perkin Transaction 2 (2002), 1187-1192
• Armstrong D.R., Benevelli F., Bond A.D., Feeder N., Harron E.A., Hopkins A.D., McPartlin M.,Moncrieff D., Saez D., Quadrelli E.A., Woods A.D., Wright D.S. Inorganic Chemistry (2002), Vol.41, 1492-1501
• Kuzmicz R.; Dubrzycki L.; Wozniak, K.; Benevelli, F.; Kolodziejski W.; Klinowski, J. Physical Chemistry Chemical Physics (2002), Vol.4, 2387-2391
• Benevelli F.; Khimyak Y.Z.; Klinowski J Journal of Inclusion Phenomena and Macrocyclic Chemistry (2004), Vol. 49, pp. 211-218
• Frassineti C., Benevelli F., Alderighi L., Gans P., Sabatini A., Vacca A., Ghelli S. Analytical Bioanalytical Chemistry (2003), Vol. 376, 1041-1052
• Consonni R., Cagliani L.R., Benevelli F., Spraul M., Humpfer E., Stocchero M. Analytica Chimica Acta (2008), Vol. 611, 31-4
LUIGI RUSSO - Curriculum Vitae
In 2008, Dr. Russo got his PhD in Chemistry at the Second University of Naples in the group of Prof. R. Fattorusso, working on the structural, dynamical and functional characterization of prokaryotic zinc finger domains. In 2009, he joined, as Post-Doc, Prof. C. Griesinger’s group at the Max Planck Institute for Biophysical Chemistry -Department of NMR-based Structural Biology, Gottingen, Germany. During this period the scientific activities of Dr. Russo were focused on the development of innovative NMR techniques. In the period 2013- 2015, Dr. Russo worked as Post-Doc at IBB of the CNR (Italy). In 2016, he was appointed as a researcher at the University of Campania “L. Vanvitelli”, where he became assistant Professor of Inorganic Chemistry and, since 2021, associate Professor of Inorganic Chemistry. Luigi Russo has a cutting-edge expertise in solution NMR structural determination and dynamics characterization of proteins and protein complexes. Actually, the research activities of L. Russo are focused on the understanding of the molecular determinants, including the role of metal ions as copper and zinc ions, that govern misfolding and aggregation processes in proteins responsible of neurodegenerative diseases.
Selected publications
- Malgieri G., Russo L., Esposito S., Baglivo I., Zaccaro L., Pedone E. M., Di Blasio B., Isernia C., Pedone P.V., Fattorusso R. “The prokaryotic Cys2His2 zinc-finger adopts a novel fold as revealed by the NMR structure of Agrobacterium tumefaciens Ros DNA-binding domain”. Proc. Natl. Acad. Sci. USA, 2007, 104 (44), 17341-17346.
- Baglivo I.*, Russo L.*, Esposito S., Malgieri G., Renda M., Salluzzo A., Di Blasio B., Isernia C., Fattorusso R. and Pedone P.V. “The structural role of the zinc ion can be dispensable in prokaryotic zinc-finger domains”, Proc. Natl. Acad. Sci. USA, 2009, 106 (17), 6933-6938.
- Palmieri M., Malgieri G., Russo L., Baglivo I., Esposito S., Netti F., Del Gatto A., De Paola I., Zaccaro L., Pedone P.V., Isernia C., Milardi D., Fattorusso R. “Structural Zn (II) implies a switch from fully cooperative to partly downhill folding in highly homologous proteins”. J. Am. Chem. Soc., 2013, 135(13), 5220 5228.
- Russo L., Maestre-Martinez M., Wolff S., Becker S., Griesinger C. “Interdomain dynamics explored by paramagnetic NMR”. J. Am. Chem. Soc., 2013, 135(45), 17111-20.
- Thestrup T., Litzlbauer J., Bartholomäus I., Mues M., Russo L., Dana H., Kovalchuk Y., Liang Y., Kalamakis G., Laukat Y., Becker S., Witte G., Geiger A., Allen T., Rome L.C., Chen T.W., Kim D.S., Garaschuk O., Griesinger C., Griesbeck O. “Optimized ratiometric calcium sensors for functional in vivo imaging of neurons and T lymphocytes”. Nat. Methods, 2014, 11(2), 175-82.
- Russo L., Giller K., Pfizner E., Griesinger C., Becker S. “Insight into the molecular recognition mechanism of the coactivator NCoA1 by STAT6”. Sci. Rep., 2017 doi: 10.1038/s41598 017-17088-5.
- Farina B., Corvino A., Del Gatto A., Comegna D., Di Gaetano S., Capasso D., Paladino A., Acconcia C., Gentile M.T., Saviano M., Fattorusso R., Zaccaro L., Russo L.*. “A novel approach for studying receptor-ligand interactions on living cells surface by using NUS/T1ρ-NMR methodologies combined with computational techniques: the RGDechi15D-αvβ5 integrin complex”. Computational and Structural Biotechnology journal, 2021, in stampa doi: 10.1016/j.csbj.2021.05.047.
- Russo L., Mascanzoni F., Farina B., Dolga A.M., Monti A., Caporale A., Culmsee C., Fattorusso R., Ruvo M., Doti N. “Design, Optimization, and Structural Characterization of an Apoptosis-Inducing Factor Peptide Targeting Human Cyclophilin A to Inhibit Apoptosis Inducing Factor Mediated Cell Death”. Journal of Medicinal Chemistry, 2021, 11445 – 11459.
- Russo L., Salzano G., Corvino A., Bistaffa E., Moda F., Celauro L., D’Abrosca G., Isernia C., Milardi D., Giachin G., Malgieri G., Legname G., Fattorusso R. “Structural and dynamical determinants of a β-sheet enriched intermediate involved in amyloid fibrillar assembly of human prion protein”. Chemical Science, 2022, in stampa doi: 10.1039/d2sc00345g.
- Diana D.*, Pirone L.*, Russo L.*, D’Abrosca G., Madheswaran M., Benfante R., Di Lascio S., Cardinelli L., Fornasari D., Acconcia C., Corvino A., Ventserova N., Pollegioni L., Isernia C., Di Gaetano S., Malgieri G., Pedone E.M., Fattorusso R. “Structural characterization of PHOX2B and its DNA interaction shed light on the molecular basis of the +7Ala variant pathogenicity in CCHS”. Chemical Science, 2024, in stampa doi: 10.1039/d3sc06427a. eCollection 2024 Jun 12.
ANGELO GALLO - Curriculum Vitae
Dr. Angelo Gallo is a chemistry researcher at the University of Torino, where his work focuses on developing new methodologies in magnetic resonance for structural biology and drug discovery applications.
His main focus as academic is the atomic level structure determination and dynamic characterization of proteins of various molecular weight that are involved in several relevant biological pathways, employing solution state and solid-state NMR techniques and computational methods. Angelo’s research seeks to determine the structure to elucidate the proteins’ network of interaction in order to define the function. He is also interested in downregulation or upregulation of these proteins as drug discovery targets. Key challenges in drug discovery are also focus of his research curiosity.
After completing his PhD in Structural Biology and a postdoctoral fellowship at the CERM, University of Firenze, he moved to the University of Warwick UK where his research focus on antimicrobial resistance and synthetic biology approaches was published in Nature Chemistry. He is a recipient of two PRIN research grants and is deeply committed to bridging the gap between fundamental research and industrial application exploiting biologically available processes.
He is currently leading a project to develop biosynthetic materials and welcomes inquiries from potential collaborators and students passionate about solving biological relevant problems using the NMR spectroscopy.
GIANLUCA D’ABROSCA - Curriculum Vitae
Università degli Studi di Foggia – Seconda Università di Napoli
Dr. Gianluca D’Abrosca earned the PhD in Molecular and Cellular Biotechnologies at the University of Campania, where had also his Post Doc in the NMR group of Prof. Roberto Fattorusso. After being Assistant Professor (RTD-A) in General and Inorganic Chemistry at the Department of Clinical and Experimental Medicine of the University of Foggia, at the present he is Assistant Professor (Tenure Track) in the same scientific area at the Department of Human Sciences of the Link Campus University of Rome.
The scientific activity of Dr. Gianluca D’Abrosca is part of the vast research topic of “Molecular Recognition” of molecules of biological interest, carried out mainly using conformational analysis techniques in solution by means of Nuclear Magnetic Resonance (NMR). In particular, the use of NMR data, integrated with spectroscopic data (I.R., UV-VIS spectroscopy, CD) and computational data (Molecular Dynamics and Molecular Docking techniques), has made it possible to obtain information
on the modes of recognition of metal ions by molecules and macromolecules, on the conformational preferences induced by the metal cofactor and, more generally, on the behavior of biomolecules in solution.
Selected Publications
1. Chaves-Sanjuan, A., D’Abrosca, G., Russo, V., van Erp, B., Del Cont-Bernard, A., Capelli, R., Pirone, L., Slapakova, M., Sgambati, D., Fattorusso, R. et al. (2024) Circular oligomeric particles formed by Ros/MucR family members mediate DNA organization in α-proteobacteria. Nucleic
Acids Res, 52, 13945-13963.
2. Diana, D., Pirone, L., Russo, L., D’Abrosca, G., Madheswaran, M., Benfante, R., Di Lascio, S., Caldinelli, L., Fornasari, D., Acconcia, C. et al. (2024) Structural characterization of PHOX2B and its DNA interaction shed light on the molecular basis of the +7Ala variant pathogenicity in CCHS.
Chem Sci, 15, 8858-8872.
3. della Valle, M., D’Abrosca, G., Gentile, M.T., Russo, L., Isernia, C., Di Gaetano, S., Avolio, R., Castaldo, R., Cocca, M., Gentile, G. et al. (2022) Polystyrene nanoplastics affect the human ubiquitin structure and ubiquitination in cells: a high-resolution study. Chemical Science, 13, 13563-13573.
4. D’Abrosca, G., Paladino, A., Baglivo, I., Russo, L., Sassano, M., Grazioso, R., Iacovino, R., Pirone, L., Pedone, E.M., Pedone, P.V. et al. (2020) Structural Insight of the Full-Length Ros Protein: A Prototype of the Prokaryotic Zinc-Finger Family. Sci Rep, 10, 9283.
5. Malgieri, G., D’Abrosca, G., Pirone, L., Toto, A., Palmieri, M., Russo, L., Sciacca, M.F.M., Tatè, R., Sivo, V., Baglivo, I. et al. (2018) Folding mechanisms steer the amyloid fibril formation propensity of highly homologous proteins. Chem Sci, 9, 3290-3298.
Comitato organizzatore
COMITATO ORGANIZZATORE
ROBERTO ANEDDA
Porto Conte Ricerche
FRANCESCA CABOI
Sardegna Ricerche
LUIGI RUSSO
GIRDM/ Università
degli studi della Campania “Luigi Vanvitelli”
Sardegna Ricerche
Sardegna Ricerche è l’ente regionale della Sardegna dedicato alla promozione della ricerca scientifica, dell’innovazione tecnologica e dello sviluppo imprenditoriale. Fondata nel 1985, l’agenzia assiste la Regione Autonoma della Sardegna nell’attuazione delle politiche per la ricerca e l’innovazione.
Le sue finalità istituzionali sono la promozione della ricerca, dell’innovazione e dello sviluppo tecnologico, l’assistenza alle imprese e l’erogazione di servizi con obiettivi di efficacia, efficienza, imparzialità, semplificazione, partecipazione e promozione delle imprese e degli organismi di ricerca.
Sardegna Ricerche gestisce il Parco scientifico e tecnologico della Sardegna che ha le sue quattro sedi a Pula (sede centrale), Macchiareddu (comune di Uta), Torregrande (OR) e Alghero (SS)
Iscrizione
22-24 Settembre 2025
REQUISITI PER L'ISCRIZIONE
La scuola è rivolta a studenti universitari, laureati, dottorandi, ricercatori (chimici, chimici farmaceutici, biologi, farmacisti, biotecnologi, fisici) e a tutti gli interessati con laurea scientifica.
COSTO DI ISCRIZIONE
Quota di iscrizione: 70 euro
Include: partecipazione alle lezioni, coffee break e light lunch previsti da programma, aperitivo sociale.
NON incluso:
- Pernottamento in hotel/strutture convenzionate.
- Trasferimenti da e per il parco.
MODALITÀ PER L'ISCRIZIONE E DEADLINE
Le domande di partecipazione dovranno pervenire entro il 10 settembre 2025.
Il numero di posti è limitato con ammissibilità alla partecipazione in base all’ordine di arrivo delle domande.
Location
EDIFICIO 2
PARCO SCIENTIFICO E TECNOLOGICO SARDEGNA RICERCHE – PULA
INFO ALBERGHIERE
Condizioni Marin Hotel PULA periodo 20-25 settembre.
Di seguito riportiamo le migliori tariffe che possiamo offrirvi per le tipologie di camere disponibili:
- Camera doppia/ matrimoniale – €115,00
- Camera doppia uso singolo – €95,00
- Camera tripla – € 145,00
- Camera family/quadrupla – € 165,00
Le tariffe includono la prima colazione a buffet, il parcheggio privato interno, la connessione wi-fi.
INFO TRASPORTI
Collegamento autobus ARST Cagliari/Parco Scientifico (Polaris): https://app.arstspa.it/quadri/134.html
Orari navetta Pula/Parco Scientifico (Polaris): Scarica allegato
In collaborazione con:
Con il patrocinio di:
Con il patrocinio di:

