CCRC NMR Spectroscopy Facility

Overview

Spectrometer descriptions

Facility policies

Charges for usage

Analytical Services

Research Groups

Other UGA NMR facilities

FACES NMR Scheduling Calendar

CCRC NMR Facility
The CCRC NMR spectroscopy facility, under the direction of Professor James H. Prestegard, is used to determine molecular structures of carbohydrates and proteins and to investigate the structural and dynamical basis of protein-carbohydrate interactions. The CCRC NMR Facility consists of three high-field Varian spectrometers (a Mercury 300 MHz, an Inova 500 MHz wide-bore, and an Inova 600 MHz) equipped for high-resolution liquids and semi-solids experiments. To initiate an analytical service contract, please contact Parastoo Azadi, 706-542-0629. Technical inquiries about the facility or NMR services should be directed to John Glushka, 706-542-4483.

GRA-UGA 800 MHz NMR Regional Facility

The GRA-UGA 800 MHz NMR Regional Facility is located at the CCRC and is available to researchers seeking the advantages of high-field systems ( field-induced orientation, high sensitivity and spectral dispersion).  NEW!  Cold probe installed with flow cell option.

NEW! Southeast Collaboratory for High-field Biomolecular NMR  900 MHz spectrometer

The SECNMR 900 MHz spectrometer has been recently installed at the CCRC. Please follow the link for further information.

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Spectrometer descriptions

The 300 MHz can be used routinely for both proton and carbon observe, but requires a probe change for P31. The 500 requires a probe change for C13 or P31 observe. The 600 requires a probe change for automated sample handling with either a conventional flow probe or the CapNMR microflow probe.

Spectrometer

300 MHz

500 MHz(wide bore)

600 MHz

Console

Varian Mercury

Varian Inova

Varian Inova

RF Channels

2

3

4

Gradients

z

z

z

Probes

5mm X{H}  ATP
5mm H{X}
5mm H,C,P,F

5mm H{CN}
5mm X{H}
8mm H{X}
5mm C{HN}
CPMAS Solids

5mm H{CN}
3mm H{X}
H{CN} flow-probe
New! Protasis CapNMR H{X} MicroFlow

Laboratory facilities, workstations, and software

Standard laboratory facilities and supplies are available for sample preparation. SUN and PC workstations running Felix (MSI), VNMR and NMRPipe are available for data processing. Data storage to CD, DVD or 4mm DAT tape is available on site.

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Facility policies

NMR data can be obtained via a service or a collaborative arrangement with CCRC personnel, or directly by researchers after adequate training on the spectrometers. Training will be provided free of charge on the 300MHz instrument. We reserve the right to confer or rescind spectrometer privileges dependent on training level, time elapsed since last session, and treatment of the spectrometer. The qualified user will be able to reserve time using FACES, our web based scheduling program.

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Charges for usage

Qualified users will be charged for the time scheduled on the spectrometer. For service work or assistance additional operator charges apply and a quote will be provided. For collaborative projects intended for co-authored publications, specific arrangements should be made with the appropriate CCRC faculty or staff member.

The following rates apply to “routine” samples of sufficient purity and amount, and with adequate supporting information (e.g. known literature data) for a straightforward analysis. Beyond simple 1D proton data, a typical sample might require a few 2D experiments and a day of analysis. More difficult samples will typically require an initial evaluation and some discussion of the cost estimate.  Sessions that require probe changes or additional hardware setup will be charged accordingly.

 

Rates[US $ /Hour]

 

Cost Category

300 MHZ

500 MHz

600 MHZ

Minimum

Academic
NonProfit

Instrument
Operator

3
40

5
40

6
40

 

Corporate

Instrument
Operator

50
50

50
50

50
50

300

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Analytical Services and Sample Requirements

Samples should be pure and contain < 50 mM aprotic salts. Mixtures and impure samples may be assessed qualitatively, but generally are not suitable for NMR analysis. For very high MW polysaccharides, broad lines in the spectra may hinder the analysis. We recommend that a lower molecular weight fragment (e.g. repeating unit, backbone without side chains, de-acetylated, etc.) also be provided if possible. To reduce the time for data analysis, any supporting literature data and/or analogous compounds should accompany the sample.

 

1D Proton

2D Proton (e.g.TOCSY)

1D , 2D Carbon (e.g.HSQC)

Analysis


Identify pure N,O-linked oligosacch.

Estimate purity or major components in mixtures.

Identify residues and linkages.
Locate substituents.

1D: Identify expected cmpd.
2D: Identify residues, linkages.

Amounts

~50 nanomoles or ~10 ug per sugar residue (.eg. 60 ug for hexasaccharide)

~100 nanomoles

1 micromole

Approx. time*

30 min

4 hours per 2D

8 hours

*On 500MHz, does not include operator time.

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Research Groups
The following research groups are primary users of the NMR facility. Initial contact should be with the facility manager, however, collaborations or other inquiries may be directed to specific researchers.

 

Contact

Research Programs, Areas of Interest

Research Groups

James H.Prestegard
Professor of Biochemistry and Molecular Biology,
and Chemistry
Varian/GRA Eminent Scholar of NMR Spectroscopy
jpresteg@ccrc.uga.edu 706-542-6281

Development of NMR methods for determining structures of proteins and carbohydrates, and their interactions.

Prestegard Lab Home Page

Will York
Assistant Professor of Biochemistry and Molecular Biology
will@ccrc.uga.edu 706-542-4628

Structural analysis of plant cell walls.

York Home Page

Russell W. Carlson
Professor of Biochemistry and Molecular Biology, and Technical Director, Plant and Microbial Carbohydrates
will@ccrc.uga.edu 706-542-4439

Molecular basis of the interaction between a bacterium and its plant or animal host. Structures of Lipopolysaccharides.

Carlson Home Page

Robert J. Woods
Assistant Professor of Biochemistry and Molecular Biology,
and Chemistry
rwoods@ccrc.uga.edu 706-542-4454

Development and Application of Computational Methods.

Woods Home Page

Geert-Jan Boons
Professor of Chemistry
gjboons@ccrc.uga.edu 706-542-9161

Synthesis of Oligosaccharides.

Boons Lab Home Page

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Other NMR facilities at UGA

Southeast Collaboratory for High-field biomolecular NMR (SECNMR) 900 MHz spectrometer

UGA-GRA 800 MHz NMR Regional Facility.

Southeast Collaboratory for Structural Genomics (SECSG); Dr. Kristen Mayer

Dept. of Chemistry; Dr. Quincy Teng

Dept. of Biochemistry and Molecular Biology; Prof. J. Urbauer

College of Pharmacy;