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PLATFORM SOLUTION
TRANSOMICS
BEST-IN-CLASS OMICS SOFTWARE
MEETS HIGH DEFINITION ESI LC/MS HARDWARE.
Last but not least they demanded a
common omics workflow to turn large,
biologically significant, multi-run
LC/MS datasets into meaningful,
publication-ready, reports.
Big challenge. Big solution.
T he Waters TransOmics™ Solution
integrates the most powerful
technologies from our unique
portfolio: Exclusive Sample Preparation
Chemistries, UltraPerformance
Liquid Chromatography (UPLC®),
UltraPerformance Convergence
Chromatography™ (UPC2®) and
High Definition MS (HDMS™),
with Progenesis® QI software
from Nonlinear Dynamics,™
a Waters company.
T he Waters TransOmics Solution
for Proteomics and/or for
Metabolomics & Lipidomics,
redefines the benchmarks for
resolving complex biological
samples and streamlining the
omics workflow – from sample
preparation to publication.
Our Centers of Innovation program
has been designed to foster
collaborations with leading life
scientists worldwide. T he keen insights
we gain from working with our
academic partners focuses our
R&D resources on developing solutions
that deliver meaningful impact to
their and your research initiatives.
Our collaborators challenged us to
develop an integrated multi-omics
research solution that:
■■ Focuses on the preferences of
proteomic researchers, molecular
biologists, and biochemists
■■ Redefines the boundaries of
sensitivity without compromising
dynamic range
■■ Maximizes feature identification
while minimizing false discovery
■■ Delivers a comprehensive range
of onboard statistical tools and
provides the ability to import
and process other vendor’s
LC/MS data (i.e., Agilent,
Bruker, ABSciex, Thermo)
The world’s leading OMICS researchers drive purposeful innovation at Waters.
“ While the last 10 years of MS-based proteomics were driven by
improvements in MS-hardware performance, it is my feeling that
the next 10 years will be driven by informatics... I am pleased
to see two strong partners in the field [Waters and Nonlinear
Dynamics] are teaming up to address this area.”
BERNHARD KUSTER, Ph.D.Chair of Proteomics and Bioanalytics, Technische Universitaet Muenchen, Germany
Waters TransOmics Solution.
TRANSOMICS SOLUTIONwith Progenesis QI Software
Waters TransOmics Solution for Proteomics and/or
Metabolomics & Lipidomics combines our uniquely powerful
High Definition Mass Spectrometry® technology (ion mobility
enhanced time-of-flight mass spectrometry (Tof MS)) with
Nonlinear Dynamics’ acclaimed bioinformatics. Each TransOmics
Solution can be configured as a dedicated system or a multi-omics
platform based on your choice of a single MS core instrument.
Choosing the Waters SYNAPT® G2-Si High Definition MS (HDMS)
System enables you to perform LC/MS and MALDI on a single
platform with the following critical features:
■■ Versatile cost-effective electron transfer dissociation (ETD)■■ Data dependant acquisition (DDA) and data independent
acquisition (DIA) ■■ Targeted analysis software for triple quadrupole-like quantification■■ Comprehensive label free data acquisition and quantification■■ MALDI acquired images enhanced by mobility separations
Or choose the Xevo® G2-S QTof, which offers a compact benchtop
platform with attomole sensitivity.
FOR P ROT EOMICS
SAMPLE PREPARATION
■■ Waters RapiGest™ enzymatic digest promoter
■■ Waters MassPREP™ quantitative standards
CHROMATOGRAPHY ■■ Waters ACQUITY UPLC® M-Class
■■ One-dimensional reversed phase (RP)■■ Two-dimensional RP/RP for low pH/
high pH separations
BIOINFORMATICS■■ Progenesis QI for Proteomics
■■ Sample comparisons across multiple groups,
analytical and biological replicates■■ Peptide/protein ID from DDA and/or DIA■■ Hi3 quantification■■ Flexible statistical tools including ANOVA, PCA,
hierarchical clustering, power analysis■■ Flexible report generator for information sharing■■ Quality Metrics, a rapid visual check of sample
measurements and analytical quality
SYSTEM VERIFICATION
■■ Waters Proteomics System Verification Kit
FOR METABOLOMICS & LIP IDOMICS
SAMPLE PREPARATION
■■ Waters Ostro™ and Oasis® chemistries for lipid
extraction/fractionation in an automatable
96-well format
CHROMATOGRAPHY
■■ Waters ACQUITY UPLC I-Class
■■ Waters ACQUITY UPLC I-Class (2D)■■ HILIC (inter-class) x RP (intra-class)
■■ Waters ACQUITY® UPC2 (1D)■■ Direct injection of organic extracts ■■ Rapid HILIC intra-class selectivity
BIOINFORMATICS■■ Progenesis QI
■■ Sample comparisons across multiple groups,
analytical and biological replicates■■ Database search for metabolite and lipid ID using
retention time, CCS, and fragmentation information■■ Flexible statistical tools including ANOVA, PCA,
hierarchical clustering, power analysis■■ Flexible report generator for information sharing■■ Quality Metrics, a rapid visual check of sample
measurements and analytical quality
■■ EZinfo Multivariate Analysis by Umetrics ■■ OPLS, PLS, PLS-DA, and S-Plot
SYSTEM VERIFICATION
■■ Waters Metabolomics System Verification Kit
Think in three dimensions of resolution.
The 3D combination of UPLC,
IMS, and MS allows the total peak
capacity (c.f. resolution) of the
analytical system to be increased
by an order of magnitude
compared to the conventional
2D LC and MS methodologies.
TW-IMS is a dispersive (i.e.,
parallel/multiplexed) technique
that separates ions according
to their Collision Cross-Section
(CCS) or size.
CCS is a precise and reproducible
physicochemical property of
an ionized molecule, delivering
four key advantages: Structure,
specificity, separation,
and sensitivity.
Thousands of structurally similar
analytes, distributed over a
daunting dynamic range pose a
massive analytical challenge.
Waters’ analytical strategy
combines three orthogonal
techniques to separate,
characterize, and quantify
the components of very
complex biological samples.
We integrate UltraPerformance
Chromatography (UPLC and
UPC2), Traveling Wave Ion
Mobility Separation (TW-IMS) and
high resolution Time-of-flight
(Tof) mass spectrometry to
deliver high definition analysis.
INTERROGATE THE M
OST COMPLEX
BIOLOGICAL SAMPLES IN THREE DIM
ENSIONS.
CCS is directly related to the size,
shape/conformation, or charge of
an analyte providing an insight to
molecular STRUCTURE.
SEPARATION by CCS allows
isobaric precursor ions to
be resolved preventing
co-fragmentation.
CCS SPECIFICITY enables
structural isomers (i.e., lipids)
to be assigned.
CCS separation delivers ions to
the Tof MS in ascending order
of size allowing optimization
of Tof duty cycle and
optimized SENSITIVITY.
UltraPerformance Chromatography, Traveling Wave Ion Mobility Separation, and High Resolution Time-of-Flight MS
Three coeluting isobaric peptide precursor ions (left) are completely resolved by TW-IMS (right).
Protein ID: SYNAPT G2-Si HD-DDA and the leading competitor DDA. 100, 500, and 1000 ng, 120 min RP, n=2, 1% FDR. SYNAPT G2-Si (blue), leading competitor (green), common identifications (grey).
High Definition Mass Spectrometry.
fold change0 0.4 0. 8 1.2 1. 6 2
0
200
600
1000
1400
1800
fold change0 0.4 0. 8 1.2 1. 6 2
0
1000
2000
3000
4000
frequ
ency
Accuracy and precision for a 1:1 fold change: SYNAPT G2-Si HDMSE (blue) and leading competitor DDA (green).
Sensitivity: peptides spiked into an E.coli matrix. HD-MRM (PRM) LOD ≤5 amol.
High Definition Imaging MALDI: ion maps for two endogenous species differing by 0.3 mDa. Equivalent to 1,800,000 FWHM.
ng100 500 1000
0
500
1000
1500
2000
ng100 500 1000
0
500
1000
1500
2000
ng100 500 1000
0
500
1000
1500
2000
HeLayeastE.coli
# p
rote
ins
2
3
4
5
1 2 3 4
log
resp
onse
log amol on column
IGDYAGIK
EALDFFAR
LVNELTEFAK
TRANSOMICS SOLUTIONwith Progenesis QI Software
Comprehensive data from a common workflow.
INNO
VATI
ON
IMPA
CT
P ROT EOMICS Accurate label-free quantification of proteins over a wide dynamic range
■■ Ultimate peak capacity
■■ Unique combination
of IMS and Tof MS for
unrivalled peak capacity
■■ Maximum in-spectrum
dynamic range
■■ Simple, scalable
informatics for
qualitative and
quantitative profiling
■■ Robust statistical
treatment of data
with simple reporting
and exporting
■■ CID and ETD
fragmentation
provides maximum
versatility
“ With Waters, you have an incredibly powerful
analytical tool capable of measuring hundreds
or thousands of molecules at the same time,
in one sample, and in one analytical run.”
JEREMY NICHOLSON, Ph.D.Professor and Chair, Biological Chemistry,Head of Department, Surgery and Cancer,Imperial College, United Kingdom
“ The results from the latest version of TransOmics have
been incorporated into the now long awaited paper
submission, and my collaborators were very pleased
with the results. Accurate mass and retention time
matching across LC/MS runs as provided by TransOmics
is essential for large-scale protein profiling – it is not
worth doing such an experiment without it.”
LEWIS BROWN, Ph.D.Director, Comparative Proteomics Center,Biological Sciences, Columbia University, United States
Standardized and normalized relative peptide abundance.
-8
-6
-4
-2
0
2
4
6
8
-8 -6 -4 -2 0 2 4 6 8
t[2]
t[1]
diseasedisease
disease
diseasedisease
disease
diseasedisease
disease
controlcontrolcontrol
controlcontrolcontrol
controlcontrolcontrol
Proteomics principal component analysis.
HDMSE (IM-DIA-MS) peptide identification.
PEPT
IDE
& PR
OTEI
N ID
■■ High peak capacity and
mass accuracy provided
by UPLC/HDMSE
■■ Powerful LC/MS technology
to routinely screen large
numbers of samples
■■ Simple data processing
and easy identification
of statistically significant
quantitative changes
■■ Export of mass information for
identification by comparison
to custom databases
METABOLOMICS Accurate sample differentiation through quantitative LC/MS
■■ Advanced liquid phase
separations provides class
definition of lipids
■■ Unique gas phase
separation of isobaric
lipid species by IMS
LIP IDOMICS Detailed quantitative and qualitative lipid characterization
■■ Confirmation of lipid identity
by CID fragmentation
■■ Quantitative profiling
of lipids by LC/MS
■■ Spatial localization of lipids
with MALDI imaging
MET I
D LIPID ID
“ We are ready to publish very soon, and with
TransOmics, it is much easier to publish results with a
single software package that does everything, rather
than explaining the different software packages we
normally use for our statistics.”
GEERT GOEMINNEDepartment of Plant Biotechnology and Bioinformatics, Ghent University, Belgium
Interactive review of metabolite or lipid data for maximum confidence in results reported.
Metabolite/lipid identification using retention time, CCS, and fragmentation information.
TRANSOMICS SOLUTIONwith Progenesis QI Software
SALES OFFICES:
Austria 43 1 877 18 07
Australia 61 2 9933 1777
Belgium and Luxembourg 32 2 726 1000
Brazil 55 11 4134 3788
Canada 1 800 252 4752
China 86 21 6156 2666
Czech Republic 420 2 617 11384
Denmark 45 46 59 8080
Finland 358 9 5659 6288
France 33 1 30 48 72 00
Germany 49 6196 400 600
Hong Kong 852 2964 1800
Hungary 36 1 350 5086
India 91 080 49292200 03
Ireland 353 1 448 1500
Israel 9723 3731391
Italy 39 02 265 0983
Japan 81 3 3471 7191
Korea 82 2 6300 4800
Mexico 52 55 52 00 1860
The Netherlands 31 76 508 7200
Norway 47 6 384 6050
Poland 48 22 101 5900
Portugal 351 21 893 61 77
Puerto Rico 1 787 747 8445
Russia/CIS 7 495 727 4490 / 290 9737
Singapore 65 6593 7100
Spain 34 93 600 9300
Sweden 46 8 555 115 00
Switzerland 41 56 676 7000
Taiwan 886 2 2501 9928
UK 44 208 238 6100
US 1 800 252 4752
Waters, The Science of What’s Possible, ACQUITY UPLC, UPLC, SYNAPT, High Definition Mass Spectrometry, Oasis, Progenesis, Xevo, and UPC2 are registered trademarks of Waters Corporation. TransOmics, Ostro, UltraPerformance Convergence Chromatography, Nonlinear Dynamics, MassPREP, RapiGest, and HDMS are trademarks of Waters Corporation. All other trademarks are the property of their respective owners.
©2014 Waters Corporation. Printed in the U.S.A. January 2014 720004282EN LM-IGS
www.waters.com/transomics
Waters Corporation 34 Maple Street Milford, MA 01757 U.S.A. T: 508 478 2000 F: 508 872 1990 www.waters.com