NuPAGE Knowledge Management By Todd Duell Voltage (V) = Current (I) x Resistance (R) Equation 1 Abstract Watts (W) = Current (I) x Voltage (V) This knowledge management document has been prepared for internal training and use. It is the culmination of information from NOVEX, literature resources, and our experience qualifying and validating the assay for internal use. It is not intended to be a comprehensive source of information for running NuPAGE gel electrophoresis, but rather a starting point to understand the technical nature of the assay and how it is used to determine the purity of our monoclonal antibodies. This document covers basic theory of electricity, NuPAGE technical information, staining options, basic monoclonal antibody data analysis, troubleshooting, recommendations, measurement of technician performance and qualification, and references. There is also a reference Excel file, NuPAGE.xls, that should be used in conjunction with the technician performance and qualification section. Electricity There are two equations that have practical consequences in electrophoresis: Equation 2 Resistance is determined by the thickness of the gel being run and the type of buffer being used. As the run proceeds, the fast moving, highly conductive Cl- ions in the gel are gradually replaced by slower moving, less conductive ions from the running buffer. This causes the resistance of the system to gradually increase as the run progresses. The power source used to run the gels will typically have three settings: constant voltage (V), constant current (I) and constant watts (W). If constant current is used, both the voltage and watts will increase as the resistance increases (see figure 1). This could cause a problem with overheating if the run isn’t monitored or a voltage limit is not set on the power unit. Unusually high resistance can be caused by frayed electrode wires, improper electrode connections, or any other break in the current flow. If this occurs, the voltage will increase sharply to compensate for the increased resistance. This can generate enough excess heat to severely damage the gel and the apparatus. If you are going to run constant current, make sure you can set the voltage limit on your power supply. Todd Duell is the Vice President & CIO of Formulations Pro, Inc and has been creating powerful commercial and custom solutions using FileMaker Pro since 1989. He holds an MBA in Technology Management and has been an Associate member of the FileMaker Solutions Alliance since 1998. Todd may be reached at tduell@formulationspro.com © 2001 Formulations Pro, Inc. All rights reserved. www.formulationspro.com If a constant wattage setting is used, the voltage will increase as current decreases, so the total amount of heat generated by the system will remain constant (see figure 2). However, if for some reason the current drops dramatically, the power supply will try to pump up the voltage to maintain a constant wattage. If using a high voltage power supply without the ability to set the voltage limit, this could cause serious damage to the gel or apparatus. The recommended method is to use constant voltage (see figure 3). There are three reasons for this. (1) If constant voltage is used, both the current and watts will decrease as resistance increases (see figure 3), thus improving safety as the run proceeds. (2) The same voltage setting can be used whether running one or two gels. One gel provides twice the resistance of two gels. To compensate, the current for one gel will be half that for two gels. As a result, the run time will be the same for one or two gels. When using constant current or watts, the setting must be adjusted for the number and thickness of the gels being run. (3) All common electrophoresis power supplies can be set for voltage, but not all will regulate the current or watts. Many people would like to run their gels as fast as possible with the same results. However, the main limiting factor is heat generation. Excess heat generation can lead to gel Page 2 distortion and poor band resolution. Figure 4 illustrates what would happen if we doubled the voltage to halve the run time. According to Equation 1 (V = I x R), if we double the voltage, the current must also double. This results in an approximate fourfold increase in the rate of energy output (5 watts to 21.25 watts). However, since we cut the run time in half, the total temperature increase is only twofold (10ºC to 22ºC). The effect that this temperature increase will have on the run depends upon the gel concentration, sample concentration and solubility, and the apparatus’s ability to dissipate heat. As shown, the higher the voltage, the more current, watts, and consequently heat is generated throughout the run. For Tris-Glycine gels, the total run time is reduced significantly from 100 minutes (125V) to 22 minutes (350V) with no visible effects and only a moderate increase in heat. Obviously the nature of the sample itself will dictate what temperature it will tolerate: heat sensitive or native proteins should be run at as low a voltage as possible to keep heat generation to a minimum. For running NuPAGE gels with monoclonal antibodies, it is recommended to use 200 Volts, constant current. The expected starting current is 110-125mA/gel. The expected ending current is 70-80mA/gel. With these settings, the run time will be approximately 35 minutes. NuPAGE Technical Information How will excess heat generated by increasing the voltage affect the quality of the results? Affects may vary, but in general, properties such as band sharpness, band curvature, resolution, temperature, and accurate band migration may suffer. These affects were studied in and reported by NOVEX in figure 5. NuPAGE in the presence of a reducing agent (DTT or bmercaptoethanol) is a technique for the separation of polypeptide subunits according to their molecular weight. The protocol involves denaturing the protein sample by heating it in the presence of LDS (lithium dodecyl sulfate) and a reducing agent. LDS binds to the protein causing it to unfold, whereas the reducing agent will reduce the intrachain and interchain disulfide bonds. The LDS will also maintain a constant charge-to-mass ratio for the protein. This ratio is assumed to be approximately 1.2g LDS/g protein. The binding of LDS by the protein confers a Page 3 net negative charge and the denatured polypeptide will migrate through the gel in the presence of an applied electric field towards the positive electrode or anode (see figure 6). When running reduced monoclonal antibodies on NuPAGE under reducing conditions, the IgG molecule will be cleaved at the interchain disulfide bonds to yield two light chains of approximately 25Kda and two heavy chains of approximately 52Kda (see figure 7). If samples are not completely reduced, they may form heterogeneous protein moities that show up as poorly resolved bands or multiple bands surrounding the main band. Sample reducing agents such as DTT or bmercaptoethanol, perform most effectively in a slightly alkaline pH environment. The NuPAGE Sample buffer has a pH of 8.45 and allows for the optimal activity of the reducing agent. The result of effective sample reduction is complete and efficient cleavage of protein disulfide bonds. While efficient cleavage of disulfide bonds is desired, cleavage of peptide bonds should be avoided for the most accurate results. The NuPAGE sample preparation protocol minimizes peptide cleavage by emphasizing the importance of heating the sample for a short period of time (10 minutes) at relatively low heat (70ºC) and reducing prior to sample loading. Whereas the traditional Laemmli system of SDS-PAGE is subject to several problems: • The gel is cast at pH 8.7. At this pH, polyacrylamide undergoes gradual hydrolysis, which eventually causes band distortion and/or loss of resolution. Consequently, the shelf life of a Tris-Glycine gel is about 1-2 months. • The pH of the separating region of the Tris-Glycine gel is about 9.5 during electrophoresis. At this pH, proteins are potentially subjected to chemical modifications such as deamination and alkylation. This may affect subsequent analyses of proteins following the run. Page 4 • The redox state of the gels is not well controlled. This means that reduced disulfides are more prone to reoxidation, giving rise to diminished band sharpness and transfer efficiency, particularly for cysteine containing proteins. • Proteins are subject to cleavage at asp-pro bonds when heated in the Laemmli sample buffer. Also, reduction of disulfides is inefficient in the Laemmli sample buffer at pH 8.6. Either condition can lead to artifacts or poor resolution. The NuPAGE system also addresses the issues that impact sample integrity during electrophoresis. The pH environment is the single most critical parameter in maintaining sample protein integrity during electrophoresis. The operating pH of the electrophoresis system (the cumulative pH of the gel and the running buffers) immediately regulates the pH environment of the sample once power is applied to the gel. At a neutral operating pH, undesirable activity of exposed disulfide groups in reduced sample proteins is kept to a minimum. As a result, proteins are kept substantially more intact and unmodified — this means consistently sharp and unambiguous bands. However, if the pH is too alkaline or acidic during electrophoresis, adverse chemical modifications, such as deamidation, dephosphorylation, alkylation, and oxidation, may occur to sample proteins. This can negatively impact the electrophoresis results in several ways. Protein modification may lead to the weakening of Western blot signals, decreased yield in protein sequencing, modifying the mass spectrum of the protein, false and/or multiple bands, and reduced purity measurements. The level of protein modification in the NuPAGE system is minimized because the system pH is neutral. The NuPAGE Bis-Tris-HCl buffers have a pH of 6.4 and when run with the MES-SDS buffers, create and effective system pH of 7. In addition to a neutral pH environment, samples reduced during sample preparation need to be maintained in their reduced states. The NuPAGE system prevents reoxidation of proteins during electrophoresis through the addition of the Antioxidant to the upper buffer chamber and transfer buffer to protect other sensitive amino acids such as methionines and tryptophans. The Antioxidant essentially migrates at the same speed as the protein to prevent this reoxidation from occurring. Whereas the LDS will migrate faster than the protein which allows reoxidation to occur. This prevents split bands and smearing as the proteins migrate through the gel (see figure 8). NuPAGE Advantages: • Full sample reduction at 70-80ºC for 10 minutes using DTT prevents denaturation of the protein. Page 5 • Using the pH 8.5 sample buffer prevents cleavage of the asp-pro peptide bonds in the CH2 domain of the heavy chain. Thus, no “degraded” bands are generated during sample reduction. • Control of the neutral pH running conditions and lower temperature during the run prevents split bands and degraded bands. Thus, eliminating confusion and increasing the purity determination. • Since DTT does not co-migrate with the proteins in the gel, the Antioxidant is used to prevent reoxidation of the reduced disulfide bonds during electrophoresis. Thus preventing split bands and smearing as the proteins migrate down the gel. • The Bis-Tris gel with a pH of 6.5 is a more effective buffer at the neutral pH range. The gel is also more pliable. Thus, enabling it to withstand higher temperatures, voltage, and current. • Since the Bis-Tris gel is cast at pH 6.4, it will last for up to one year. Molecular Weight Estimations Two factors explain the observation that there are apparent discrepancies between the size as determined by gels versus other methods such as sequence analysis and size exclusion chromatography. First is the amount of LDS bound to the protein. LDS is employed to disrupt the secondary structure and give all proteins a constant chargeto-mass ratio. However, as stated by Hjelmeland and Chrambach, this assumption fails more frequently than is generally known. The most common deviation from this assumption is probably a lower than normal amount of LDS. This is usually caused by under pipetting the Sample buffer due to the high viscosity of the buffer. A simple solution is to simply turn up the volume on the pipetman by 50-100%. All else being equal, mobility would decrease, since the protein would have less of a negative charge. The second source of error in molecular weight estimates is that protein mobility in a gel is more a function of molecular size (which is a function of both weight and length) than of molecular mass. It’s generally assumed that LDS proteins all exist in a random coil form, so the relationship between the length and mass should be constant. Even assuming constant charge; if a protein has unreduced disulfide bonds or areas of incompletely disrupted secondary structure, it cannot unfold to full length and, it would tend to run faster than expected in a typical NuPAGE gel. These deviations from the ideal can combine in every conceivable way, making it difficult to predict a net effect on migration rate. Nevertheless, the effects can be large. For example: BSA will run with an apparent size of 55Kda instead of 67kDa. Furthermore, in smaller proteins a non-ideal region will have a larger proportional effect than the same region in a large protein. For example, polypeptides of around 2kDa can give estimates that are off by a factor of 2 or more from the actual size. This is not to say that NuPAGE derived molecular weights are invalid, just to say that they have limitations. Most proteins will give estimates within a few percent of their actual weight by comparing them to appropriate calibration markers. The closer the marker is to the lane in the gel, the more accurate the measurement. And possible deviations from “true” molecular weight do not affect the utility of NuPAGE gels in Page 6 identification because even unusual proteins, if prepared in the same way each time should run reproducibly on a given type of gel. Finally, care should also be taken in inferring precise size based on published weights for calibration markers. Even common proteins may have several slightly different size estimates reported in the literature, depending upon the methods of molecular weight measurement. We use the NOVEX Mark12 Wide-Range Protein Marker for NuPAGE (see figure 9). The standards used in this marker behave close to their ideal molecular weight. Mark12 provides sharp stable bands, which make sample calibration easy and quick with the help of the densitometer. The Mark12 contains 12 proteins ranging from 2.5 to 200kDa for calibration of any gel from 4% to 27% as well as gradient gels such as the 4-12% Bis-Tris gel used in the NuPAGE process. Optimal Sample Loading A good sample loading strategy is an important part of optimizing an electrophoresis system to obtain high quality gel results. This involves determining the correct concentration of each individual protein, the composition of the solubilization buffer and the total sample volume per lane. The concentration of total sample protein should be scaled so that each protein of interest is at an optimal load. This load should be enough to be visualized with the chosen staining method, but should not exceed the physical capacity of the gel matrix. This is determined by dimensions such as thickness, and height and width of the sample well. As a general rule, the sample should occupy as low a percentage of the total well volume as possible. Here at BD/PharMingen, monoclonal antibodies have been optimized to give reproducible results using densitometry analysis when the protein sample volume is 10µl and the concentration is between 0.5 to 2.0mg/ml (see figure 10). If a protein exceeds the capacity that the gel matrix can accommodate, excessive localized heat is generated as a heavy overloaded protein band migrates down the gel. In extreme cases, proteins may migrate between the gel and the cassette, resulting in a ghost band. Or in less extreme cases, the band will smear downwards and be poorly defined, giving an inaccurate lower estimation of molecular Page 7 Excessive total sample volume can also cause sample crossover from lane to lane, causing thin lines or smudges or duplicate band patterns of the adjacent sample. If a protein is very dilute, concentration may be necessary. Finally, to obtain the best results, total sample volume should be kept consistent from lane to lane. Staining & Gel Drying weight and purity. The excessive heat generation may also distort nearby protein bands in adjacent lanes in a similar fashion. Sample buffers have several purposes as previously stated. The NOVEX reducing agent has sufficient LDS to denature typical protein concentrations. In order to create an environment where the role of protein charge is minimized as much as possible, LDS should be added in excess of the ration of 1.6g LDS: 1g protein. Glycerol is present in the NOVEX sample buffer to increase the density of the sample. This ensures that the sample will sink to the bottom of the well and facilitates correct stacking of the proteins. Once a sample is prepared and diluted properly, it’s ready to load. The total sample volume in the well will affect your end result. As a general rule, the well should not be filled with more than 75% of its total volume. Stacking of proteins may also be affected if the sample volume is too high: the larger proteins within the total sample may not reach the stacking portion of the gel in time to be stacked, leading to fuzzy and poorly resolved bands. The staining process used to detect and quantify antibody purity utilizes G250 Colloidal Coomassie staining chemistry. This process provides nanogram-level detection of proteins and crystal clear backgrounds without a harsh chemical de-staining process. The method is based on the colloidal properties of Coomassie Blue dye created in aqueous or methanol solutions containing inorganic acids and high salt concentrations. The free dye in solution is greatly reduced due to the hydrophobic effect, resulting in low background staining and high affinity binding of the dye to the proteins fixed in the gel. This method of staining is five times more sensitive than the traditional R250 Coomassie technique. With G250, 10ng of protein can be detected on standard 4-12%, 1.0mm thick TrisGlycine gel. The key to the process however lies in the downstream capabilities afforded by this method. The 10-minute ethanol and acetic acid rinse removes the SDS and opens up the gel pores to enhance the staining capabilities of the dye. The DI Water destain process does not remove the dye from the protein. As a result, you are left with a crystal clear background that enables densitometry quantitation of purity to be far more accurate and consistent (see figure 11). Page 8 There are trade-off’s in the process between traditional R250 and Colloidal G250 as shown in figure 12. If you don’t need to perform densitometry analysis, the recommendation is to use traditional Coomassie R250 techniques. However, if densitometry analysis is required, there is no better choice than Colloidal G250. Once you’ve stained your gels, it is imperative to dry them appropriately for long term storage and use. If the gels are not treated properly, they will eventually crack and shrivel up — rendering them useless. The drying of gels between two sheets of transparent cellophane after electrophoresis and staining is a convenient way to preserve and permanently store the gels. Gel drying can become a frustrating experience if your gels crack during the process, since a single gel can represent hours of time invested into the sample preparation, running, and staining of the gel. Gels should be handled with care when removed from the cassette to ensure that all the edges are as straight as possible. Even slight nicks and tears can act as starting points for large cracks to develop. One recommendation to limit this from happening is to remove the loading wells and the foot of the gel with the use of a gel knife. If physically handling the gel, the bottom of the gel with a higher concentration of material is stronger than the stacking portion (top) of the gel with a low percentage of material. Immediately after removing the wells and the foot of the gel, the gel should be equilibrated in a drying solution. The drying solution contains alcohol to prevent excessive swelling of the gel as well as glycerol, which helps to regulate the rate of drying. Therefore, preventing cracking. Since the alcohol can remove stain from the proteins in the gel, it should not be soaked in this solution for more than 10 minutes. The gel is then placed between two pieces of cellophane for support to help prevent the gel from shriveling up. To prevent cracking, it is critical not to allow trapped air between the cellophane sheets and the gel. There are several methods to remove the trapped air from under the cellophane sheets. First, Page 9 don’t be afraid to use too much DI Water when preparing the cellophane sheets and the gel on the platform — more is better. Second, if air bubbles are still trapped between the cellophane sheet and the gel, gently press them out to the edge of the gel with your finger. Third, use a transfer pipette to suck the bubble away from the gel. Once you have the gel prepared for drying, it will take approximately 24 hours for a passive drying system. There are several types of faster drying systems available such as vacuum and convection ovens, but one should be aware of the pitfalls involved in using these devices. While drying the drying period is shortened, the rapid rate at which water is removed from the gel increases the chances of cracking. Another concern exists when using a heated gel dryer. The rate of the heat flowing across the gel can be inconsistent from one drying session to the next. Thus making it difficult to determine the exact length of time for drying. Excessive heat can also cause the cellophane to shrivel up. interchain disulfide bonds, leaving a set of 52kDa (heavy chain) and 25kDa (light chain) components (see figure 13). The IgM antibody is made up of a pentamer (5) of Ig molecules held together by a J chain (see figure 14). The J chain is not cleaved during reduction. Therefore, the reduced heavy chain for an IgM will actually have two heavy chain subunits with a combined size of approximately 100kDa (see figures 13 and 14). IgA can come in the form of a dimer or a monomer. In the event that the molecule is a dimer, the reduced results may be similar to an IgM molecule. Otherwise the reduced results will be similar to an IgG molecule. Data Interpretation The data interpretation that is provided covers the majority of the typical scenarios for monoclonal antibodies purified by affinity chromatography: normal IgG and IgM/IgA, bovine Ig, mycoplasma, split or double bands, 30kDa bands, degraded antibody, HPCD issues, and gel “smiling”. The reasons for all variations are as diverse as the problems that may cause them. I would hesitate to provide an exact cause in some cases without specific investigation. Therefore, only a list of possible causes will be given for each of the cases shown below. In some cases the IgM’s J chain will be broken during reduction and/or electrophoresis. If this happens, there will be a mixture of 100kDa, 52kDa and 25kDa bands on the gel. All three should be included in the purity of the product unless you are aware that the 52kDa band belongs to an IgG molecule (see figure 15). IgG, IgM, and IgA Identification: As previously mentioned, during reduction, the IgG antibody will be cleaved at the Page 10 weight bands have a strong correlation with this bovine Ig complex. The bovine Ig bands are not included in the purity of the product. Bovine Ig (gamma globulin) Identification: In most cases, 1% to 10% fetal bovine serum (FBS) is fed to the tissue culture to aid in stimulating the cells to grow and secrete antibody. Some of the gamma globulin complex will bind to the affinity resin during the purification process and elute with the product. In the cases where there is a relatively high ratio of bovine Ig to antibody, there will be three distinct higher molecular weight bands that appear on the gel (see figure 16). From previous IEF studies with purified FBS, we know that the pI is 4.8 to 5.2 and that the three high molecular Mycoplasma Identification: We are not actually identifying mycoplasma with NuPAGE because mycoplasma does not bind to affinity chromatography resin. What we are identifying is the protein that is left behind from the presence of mycoplasma in the tissue culture. Mycoplasma secretes a 95 to 105kDa dimer protein that binds to the Fab region of the light chain nonimmunologically (see figure 17). Under reducing conditions the mycoplasma protein is broken down into two components — two 43kDa subunits and two 10kDa subunits (see figure 18). If these appear on the gel it is usually a clear indication of mycoplasma contamination. There is also some speculation that when the PCR-based mycoplasma and Western blot assays are negative that this problem is caused by protease activity. Either way, purification protocols are unable to solve the contamination or degradation problems. Fixing the tissue culture is the only course of action that can solve the problem. The 43kDa and 10kDa bands are not included in the purity of the product. Page 11 electrophoresis, different molecular weights for each heavy or light chain component, or even the molecule being a different size that the Bovine Ig heavy or light chain. Which will then show both sets of bands. In any case, split bands do not mean that the antibody is of poor quality. In most cases both bands will be included in the purity of the sample. Split Heavy Chain and Light Chain Identification: This is identified by two or more heavy or light chain bands that are close together (see figure 19). They are not to be confused with a 30kDa band (see below for more details). It could arise from a variety of sources such as reoxidation during 30kDa Band Identification: The 30kDa band is slightly higher than the light chain band (see figure 20). This is not to be confused with a split light chain where the bands are very close together. The 30kDa band can come from a variety of sources such as reoxidation during electrophoresis, degradation, and protease activity. However, it is usually associated with a separate protein secreted from the hybridoma’s fusion partner. This protein may need to be present for the activity of the protein. However, unless its origin is known (i.e. the fusion partner is a know secretor), it will not be included in the purity of the sample. Page 12 of the gel. As a result, it sucks in the adjacent lanes (see figure 22). This problem is more pronounced with higher concentrations of HPCD. If you need to run a sample with HPCD, it is highly recommended to leave the adjacent lanes open. Degraded Antibody Identification: Any bands that are below the light chain are considered degraded antibody. Whether it is from protease activity, mycoplasma, degradation during reduction and electrophoresis, these bands are not included in the purity of the sample (see Figure 21). Gel “Smile” Identification: As mentioned above, the proteins will migrate at different rates as you move away from the center of the gel. This phenomenon is called gel “smiling” (see figure 23). It does not affect the purity calculations, but it will affect molecular weight estimations the further away the sample is from the standard. HPCD Identification: HPCD is essentially a big sugar molecule. During electrophoresis, HPCD pulls the water out Page 13 called two-population, dependent Hypothesis testing can be used to measure their capability to provide accurate data. Step 1: State the question and Null Hypothesis. Are the technician’s values the same the approved values? Ho = the approved values. H1 = the technician’s values. Technician Qualification and Performance Measurement How do you measure the qualification and performance of your technicians and trainers to ensure quality and consistency not only for an individual technician but also within and between groups? What qualification and performance measures should be used? These measurements can be performed with a variety of simple statistical techniques explained below. Technician Densitometer Qualification Technicians can be qualified to use the densitometer for providing purity quantitation by measuring their test results against an “approved” set of qualified results or “standards”. These standards should contain a normally distributed variety of extreme results such as high background and extra and/or contaminant bands. The more results the technician scans, the more accurate the results. There should be at least 30 results to be statistically significant and not have to adjust for additional degrees of freedom. With the technician’s results, a statistical measure Ho=H1 Ho≠H1 Step 2: Determine the Confidence Interval (a) and select the Test Statistic (s or t). a = 0.05 (95% Confidence Interval) z = 1.96 (2-tailed test. The z statistic is used because the standard deviation of the approved values is known and 30 values will be measured.) Step 3: State the Rejection Hypothesis for a 2-tailed test. Reject Ho if z >1.96 Reject Ho if z >-1.96 Step 4: Calculate the z value. z= d Sd ÷ n Equation 3 Page 14 Where: S d = 2 (Â d) ÷ n˘˙˚ Â d 2 - ÈÍ Î n -1 d = Approved Values — Technician’s Values Step 5: State the conclusion. Do not Reject Ho if z < 1.96 or z >-1.96. Reject Ho if z >1.96 or z <-1.96. If the Null Hypothesis (Ho) is rejected, the technician’s values are not the same as the approved or standard values. The trainer will then need to investigate the reason why they are not the same. If the Null Hypothesis is not rejected, the technician’s results are the same as the approved or standard values and the technician is approved to perform the analytical testing. The technician should not be allowed to perform the analytical testing until they meet the qualification standards. For further information, see the Densitometer Analysis Qualification worksheet in the NuPAGE.xls file. Technician Long Term Performance Monitoring Once the technician has been qualified to perform the analytical quantitation, a long-term strategy has to be in place to ensure that consistent results are reported. Since one of the biggest factors in providing consistent and accurate data is the background staining of the gel, this will be the easiest value to monitor. The method to monitor the long-term performance is call Statistical Process Control (SPC). A process is considered capable if it has a process distribution whose extreme values fall within the upper (UCL) and lower control limits (LCL). The LCL value would be the background associated with a gel that has been run through the electrophoresis process without samples or the staining process (approximately 0.048 OD). The UCL value would be the average of several gels that have been run with samples and stained (approximately 0.052 OD). As a general rule, most values of a process should fall within ±3s of the mean. Hence, if a process is considered capable, the difference between the upper and lower specifications must be greater than 6s. This is called the Process Capability Ratio (Cp). Cp = (UCL — LCL) ÷ 6s Equation 4 Critical Value: 1. If Cp >1.0, the tolerance range is greater than the range of actual process outputs and the process will produce products within their allowable tolerances. 2. If Cp <1.0, the tolerance range is less than the actual process outputs and the process will produce products outside their allowable tolerances. The process is considered capable only when Cp is greater than the Critical Value (i.e. 1.0) and the process distribution is centered on the mean value of the tolerances. For example, if the process distribution is closer to the UCL, the likelihood that defects will occur is higher. Thus, we need to compute the Process Capability Index (Cpk) that measures the potential for the process to generate outputs relative to either the UCL or LCL. Page 15 Equation 5 Cpk = Minimum of [(Mean — LCL) ÷ 3s, (UCL — Mean) ÷ 3s] In this equation, we take the minimum of the two ratios because it represents the worst case situation: • • If Cpk > 1.0 and Cp > 1.0, the process is considered capable. If Cpk < 1.0, the process average is close to one of the tolerance limits and is generating defective output. Cpk will always be less than or equal to Cp. When Cpk equals Cp, the process is centered between the UCL and LCL and hence the mean of the process distribution is centered on the mean of the specifications. If you graph these results using Excel, what you will see is a graph similar to figure24. It’s always good to graph the results so you can visually monitor and stop the process if there are any emerging trends that could result in problems. For further information, see the SPC worksheet in the NuPAGE.xls file. Measuring Group Consistency The way to measure group performance (for background OD consistency) of two or more technicians is through ANOVA (analysis of variance) analysis. In performing ANOVA, you determine what part of the variance you should attribute to randomness and what part you can attribute to other factors. ANOVA does this by splitting the total sum of squares into two parts; a part attributed to differences between groups and a part due to random error or random chance. For ANOVA to work, there are three assumptions that must be true: • • • The data must be Interval (zero has no meaning) or Ratio (zero has meaning) The data must be normally distributed. All the variances (between technicians) are equal. Variance Testing Before spending the time to perform all the ANOVA calculations, every possible combination of variances should be tested. You will need to know the mean, standard deviation and sample size for each technician. The sample sizes don’t have to be the same. You will also need access to an F distribution statistical table to perform this function. Step 1: State the question and Null Hypothesis. Is the variance for technician 1 different than technician 2? Ho: s21 = s22 H1: s21 ≠ s22 Page 16 Step 2: Determine the Confidence Interval (a). Ho is not rejected, you can proceed with ANOVA analysis because the variances are the same. Remember that all possible combinations of technician results must be tested before including them in ANOVA analysis. a = 0.10 Step 3: Select the Test Statistic (F). 2 1 2 2 F = S ÷ S Equation 6 S21 is always the larger standard deviation value. If you don’t have access to an F table, I would recommend using the Excel F-Test Two-Sample for Variance built in function to perform you calculations. For further information, see the Background OD ANOVA worksheet in the NuPAGE.xls file. S22 is always the smaller standard deviation value. Step 4: State the decision rule for a 2-tailed test (positive values only). Reject Ho if F > (df1 ÷ df2) = (n1 –1) ÷ (n2 –1) n1 = the sample size numerator value for the S21 standard deviation n2 = the sample size numerator value for the S22 standard deviation Use the 0.05 F table for a = 0.10 to find the F value. Step 5: State the conclusion. Reject H0 if: S21÷ S22 > (n1 –1) ÷ (n2 –1) Do not Reject H0 if: S21÷ S22 < (n1 –1) ÷ (n2 –1) If Ho is rejected, you cannot perform the ANOVA analysis because the variances are not the same. If Page 17 ANOVA Testing The easiest way to perform this calculation is to use Excel’s Data Analysis function. To understand the meaning of the F calculation that Excel will give, ANOVA is calculated as follows: Step 5: Calculate F and make the decision. Step 1: State the question and the Null Hypothesis Ho: µ1= µ2= µ3… H1: Not all µ’s are equal Step 2: Select the level of significance. a = 0.05 SSTR = Â nj j=1 Step 3: Select the test statistic. F = Between Sample Variances ÷ Within Sample Variances K n SSE = Â Â j =1 i =1 (x -x ) (x j 2 ) ij - x j Where: Step 4: State the decision rule. F > (K - 1) ÷ (N – K) 2 K Equation 7 K = the number of technician’s being compared N = the total number of data points being compared Results are taken from an F statistic table where (K-1) is the numerator value and (N-K) is the denominator value. j = column number i = row number nj = sample size of the column x j = mean of the column x = mean of the means Reject Ho if (K-1)÷(N-K) > MSTR÷MSE Page 18 If you Reject Ho then your group is not providing consistent data. If you do not Reject Ho then your group is providing consistent data. These calculations can get pretty nasty as you compare more and more data. In this case, I strongly recommend that you use the built-in ANOVA-Single Factor calculations provided by Excel. For further information, see the Background OD ANOVA worksheet in the NuPAGE.xls file. • Has previously met all the statistical qualification for accuracy and consistency. • Able to explain the technical details of the analytical process for running gels as well as evaluating and monitoring the qualification and performance of the technicians. • Able to correctly answer questions about the theory, routine technical and troubleshooting issues. • Is able to troubleshoot raw materials and equipment problems. • Has demonstrated the ability to correctly interpret the analytical results. • Is capable of communicating all of the training information with the technicians during the training process. • A high percentage of technicians are able to pass the rigorous qualification process after receiving training. • Has demonstrated superior communication abilities. Troubleshooting & Recommendations Trainer Certification There is frequently a question about the difference between who is qualified to run NuPAGE and who is qualified as a NuPAGE trainer. Some of the differences that separate a trainer from a technician include: • Why is Bis-Tris used as the gel buffer as opposed to Tris, which is used in the Tris-Glycine system? Bis-Tris has a pKa of 6.5, so it is a useful buffer in the neutral pH range. Tris, on the other hand has a pKa of 8.1 and is not an effective buffer below 7.4. Page 19 • Is there SDS in the NuPAGE Bis-Tris gels? • No. Sufficient denaturing conditions are created by the LDS in the sample buffer. • • The NuPAGE Bis-Tris gels are composed of a different matrix, and as a result are slightly more pliable. They are also more resistant to heat during the electrophoresis process. Why can’t I run NuPAGE under native conditions? The high ionic strength of the NuPAGE system provides good stacking of LDS denatured proteins but creates too much heat for many native proteins. Also, at neutral pH, many native proteins do not have enough of a charge on them to migrate. • Is the stacking gel shorter on the NuPAGE gels in comparison to other gels? Yes, by about 20%. This still allows for complete stacking of proteins while increasing the length of the separating gel. • What are the storage conditions for the NuPAGE gels? The life expectancy of the gels is 1 year if stored in the cold room (2-8ºC). However, the performance of the gels will not suffer if they are left out at room temperature temporarily or even over the weekend. Why is the NuPAGE Sample Buffer pH 8.45 if the claim is that a neutral pH environment is better for electrophoresis? For optimal sample preparation in all SDS-PAGE protocols it is best to denature and reduce the protein disulfide bonds under slightly alkaline pH conditions. Sample reduction at the pH of the NuPAGE Sample Buffer (pH 8.45) allows for maximum activity of the reducing agent. Also, heating should be controlled to mild conditions (70ºC) for a short period of time (10 minutes). After the controlled sample preparation step, the neutral pH in the electrophoresis environment keeps the reactivity of the disulfide groups on reduced sample proteins to a minimum. Is there a stacking gel on the NuPAGE gels? Yes, it is a 4% stack. • Why are the NuPAGE gels more pliable that other types of gels? • Why is the NuPAGE Sample Buffer so difficult to pipette? The NuPAGE Sample Buffer is a 4X concentrated solution. The presence of sucrose also increases the viscosity of the NuPAGE Sample Buffer. There are two recommendations to deal with this issue. First, by brining the Sample Buffer to room temperature (25ºC) either by storing it at room temperature, placing it in a water bath, or an incubator, will make the Sample Buffer easier to manage. Second, when Page 20 pipetting the solution, increase the micrometer setting by 50 to 100% to ensure that the correct quantity of Sample Buffer is used. • Can other reducing agent be used other that DTT — such as b-mercaptoethanol? The NOVEX Reducing Agent is 500mM Dithiothreitol 10X concentrate in a stabilized, liquid form. The advantage to using DTT from NOVEX is that it is ready to use. Thus, there is no need for preparation from powder. DTT is also far safer than b-mercaptoethanol from a hazardous material stand point. b-mercaptoethanol is compatible with the NuPAGE system. The choice of reducing agent is usually a matter of preference or habit. In any case, the sample preparation protocol should still be followed whether using DTT or BME. However, it’s always a good idea to leave the reducing agent out of the sample until just before the run. To prevent exposure to a hazardous chemical BME should be prepared and used under a fume hood. • • The antioxidant is intended to keep sample proteins which have already been reduce in the sample preparation step from reoxidizing during electrophoresis. The antioxidant itself is not efficient to reduce disulfide bonds. If antioxidant is used when no previous sample reduction is performed, the end result will be partially reduced bands with susbstancial background smearing traveling down the lane. • If DTT is added to the sample during sample preparation, shouldn’t that be sufficient to keep the samples reduced during electrophoresis? What is the exact purpose of the Antioxidant? In the neutral pH environment, DTT (and BME) do not comigrate through the gel with the sample. While the disulfide bonds are less reactive at neutral pH and therefore less likely to reoxidize than in a higher pH system, some reoxidation may occur during the run, resulting in slightly diffuse bands. By adding the Antioxidant, which does comigrate through the neutral pH during the gel, proteins are kept from reoxidizing. Additionally, the Antioxidant protects sensitive amino acids in addition to cysteine groups such as methionines and tryptophans from oxidizing. Thus, band sharpness will be enhanced. How fresh does the Reducing Agent have to be in order to obtain complete reduction? The Reducing Agent should be added to the sample within one hour of loading onto the gel. As long as the Reducing Agent (DTT) is used within the expiration date, the results are reproducible. Since the Reducing Agent is purchased as part of a kit for 10 gels, when the last gel is used please throw away all the components of the kit to ensure that expired materials are not being used. What happens if I forgot to reduce my sample? Will the antioxidant create reducing conditions? • Can I run reduced samples with non-reduced samples on the same gel? If so, do I still add the Antioxidant to the Running Buffer? Page 21 For optimal results, it is not recommended to run reduced and non-reduced samples on the same gel. However, if you choose to mix reduced and non-reduced samples on the same gel, they should not be placed in adjacent lanes. The reducing agent may have a carry-over affect on the non-reduced sample if they are too close in proximity. Also, if you are running non-reduced samples, you should not add the Antioxidant to the upper buffer chamber. The Antioxidant may slightly reduce native proteins. • How fresh should the Antioxidant be when it is added to the upper buffer chamber? It should be used within 30 minutes of preparation. Substantial loss of activity has been observed if it is used two hours after preparation. The proteins may exhibit signs of reoxidation. • Can the NuPAGE Antioxidant be used in other gel systems? No. It’s not efficient at the higher pH’s of other systems. Why can’t I filter the G250 Colloidal Coomassie dye solution before I use it? The colloidal dye particles that are formed in solution will be retained on the filter. • Why does the G250 stain need to be prepared fresh before I use it — can’t I just mix all the stain components together to make a final stock solution? The G250 stock staining solution is stable for prolonged periods of time, but should be agitated thoroughly before it is used. The methanol, ammonium sulfate, and phosphoric acid solution should not be prepared in advance as a result of evaporation of the methanol. The reduction in methanol due to evaporation will reduce the rate of staining in the protein. How poor will the results be if I forgot to add the Antioxidant to the upper buffer chamber? Some bands may be slightly fuzzier, diffuse, and/or split than if the Antioxidant is used due to some reoxidation during electrophoresis. There will be differences from protein to protein. • • • If methanol can destain the gel, why is it used in the staining process? The inclusion of 20% methanol into the G250 staining solution shifts the equilibrium form the colloidal form to the molecularly dispersed dye form, facilitating diffusion into the gel matrix with resultant faster and more complete protein staining throughout the entire cross section of the gel. Higher concentrations of methanol, as in conventional R250 staining protocols result in heavy background staining, and in addition, strongly interfere with the formation of protein-dye complexes. The formation of stable protein-dye complexes is crucial for high staining sensitivity whereas the formation of colloidal dye particles is crucial for avoiding background staining. Having a clear background and thoroughly stained Page 22 proteins is critically important for accurate and reproducible densitometry analysis. • What is the purpose of the ammonium sulfate in the staining solution? The formation of colloidal dye particles depends on the concentration of ammonium sulfate in the staining solution and determines the background staining. The optimal concentration is 8% ammonium sulfate to keep the background of the gel clear. • • I need to analyze a large molecular weight protein — what is the largest protein that can be separated by the NuPAGE Bis-Tris gel? What is the purpose of the phenol red in the Sample Buffer? Phenol red is used as a true ion-front tracking dye for the very small pore-sized gels. Phenol red is smaller than Coomassie G250. In high percentage gels, molecules of this size are resolved on the basis of size, such that phenol red runs with the ion front while G250 can run as much as 2cm behind the ion front. It is generally a more useful tracking dye than G250. What is the purpose of the initial destain step using acetic acid and methanol? The methanol opens up the gel matrix pores, which allows the acetic acid to facilitate the removal of LDS from the protein and gel. This step will enhance the staining of the Coomassie G250 stain. • process, we have qualified a10µl sample at 0.5 to 2.0mg/ml as the optimal loading volume and concentration. If you load too much volume or too high a concentration, it will overload the gel. As a result, the entire lane may be smeared and/or overlap into the adjacent lanes. • Why is LDS (lithium dodecyl sulfate) used in the Sample Buffer rather than SDS (sodium dodecyl sulfate). SDS in the 4X Sample Buffer tends to precipitate out of solution and to make the buffer more viscous and difficult to pipette. LDS is much more soluble even at cold room temperatures (2-8ºC). The largest size the Bis-Tris gel can resolve is 400kDa (reduced Laminin). Proteins larger than this will not be able to exit the stacking portion of the gel. • How much sample can I load into the well? No more than 75% of the total well volume should be loaded. Preferably, the smallest possible volume should be used to achieve the sharpest bands. For the NuPAGE Page 23 References 1. www.invitrogen.com. 3/23/2001. 2. Hjelmeland, L.M. and Chramback, A., Electrophoresis 1981, 2, 1-11. 3. Sallantin, M., Huet, J., Demarteau, and Pernollet, J., Electrophoresis 1990, 11, 34-36. 4. Moos, M., Journal of Biological Chemistry, Vol. 263, pg. 6005-6008. 5. NuPAGE Electrophoresis System Technical Guide. Version EP049, 1996. 6. Davagnino, Juan, et al, Acid Hydrolysis of Monoclonal Antibodies. Journal of Immunological Methods, 1995, 185, 177-180. 7. Kubo, Kanenobu, Effect of Incubation of Solutions of Proteins Containing Dodecyl Sulfate on the Cleavage of Peptide Bonds by Boiling, Analytical Biochemistry, 1995, 225, 351-353. 8. Abstract from the Ninth Symposium of the Protein Society, July 1995. Protein Science 4 (Suppl.2):161. 9. Novex News, The Power of Electrophoresis, Volume 2, Issue 4, 1993. 11. Novex News, Sensitive, Easy, Colloidal Coomassie Staining Kit, Volume 4, Issue 2, 1994. 12. Novex News, NuPAGE: Sample Stability ~ A Crucial Element in Superior Electrophoresis Results, Volume 6, Issue 1, 1996. 13. SOP: MF/5162, Performing NuPAGE Gel Electrophoresis Using a Precast SDS-PAGE Gel and Electrophoresis Cell From Novex, Revision 3, 10/16/2000. 14. Chait, B.T. and S.B.H. Kent, Science, 257: 1885-1894 1992. 15. Woods, E.F., Himmelfarb, S. & Harrington, W.F., J. Biol. Chem., 238, 2374 1963. 16. Brown, J.R., Fed Proc., 34 591 1975. 17. Jolles, P., Agnew, Chem. Intl. Edit., 8, 227 1969. 18. Neuhoff, et al; Improved staining of proteins in polyacrylamide gels including IEF gels with clear background at nanogram sensitivity using Coomassie Brilliant Blue G250 and R-250. Electrophoresis 1988, 9, 255-262. 19. NOVEX, Colloidal Coomassie Stain Instructions. 20. NOVEX, NuPAGE Electrophoresis System Instructions. 21. NOVEX, Precast Gel Instructions. 10. Novex News, Molecular Weight Estimation and SDSPAGE, Volume 2, Issue 1, 1992. Page 24 22. Berk, Kenneth and Carey, Patrick. Data Analysis with Microsoft Excel. Duxbery Press 1998. 23. Alexander, Angelia, et al. Identification of a Mycoplasma Protein Which binds Immunoglobulins Nonimmunologically. Infection and Immunity, June 1991, pg. 2147-2151. 24. Maddsen, Randall, et al. Species-Specific Monoclonal Antibody to a 43,000 Molecular Weight Membrane Protein of Mycoplasma pneumoniae. Journal of Clinical Microbiology, October 1986, pg. 680-683. 25. Pawar, Anil. Applied Managerial Statistics — MGT/572. University of Phoenix. Masters in Business Administration, Technology Management, 2000. Page 25