#METABOLOMICS WORKBENCH mbcolonna_20200812_100701 DATATRACK_ID:2116 STUDY_ID:ST001476 ANALYSIS_ID:AN002452 PROJECT_ID:PR001000 VERSION 1 CREATED_ON August 31, 2020, 6:12 pm #PROJECT PR:PROJECT_TITLE Predicting T Cell Quality During Manufacturing Through an AI-based Integrative PR:PROJECT_TITLE Multi-omics Analytical Platform PR:PROJECT_SUMMARY Large-scale, reproducible manufacturing of therapeutic cells with consistent PR:PROJECT_SUMMARY high quality is vital for translation to clinically effective and widely PR:PROJECT_SUMMARY accessible cell-therapies for patients. However, the biological and logistical PR:PROJECT_SUMMARY complexity of manufacturing a living product, including challenges associated PR:PROJECT_SUMMARY with their inherent variability as well as uncertainties of process parameters, PR:PROJECT_SUMMARY currently make it difficult to achieve predictable cell-product quality. Using a PR:PROJECT_SUMMARY degradable microscaffold-based T cell manufacturing process as an example, we PR:PROJECT_SUMMARY developed an Artificial Intelligence (AI)-driven experimental-computational PR:PROJECT_SUMMARY platform to identify a multivariate set of critical process parameters (CPPs) PR:PROJECT_SUMMARY and critical quality attributes (CQAs) from heterogeneous, high dimensional, PR:PROJECT_SUMMARY time-dependent multi-omics data, measurable during early stages of manufacturing PR:PROJECT_SUMMARY and that are predictive of end-of-manufacturing product quality. Sequential, PR:PROJECT_SUMMARY Design-of-Experiment (DOE)-based studies, coupled with a set of agnostic PR:PROJECT_SUMMARY machine-learning framework, was used to extract multiple feature combinations PR:PROJECT_SUMMARY from Day 4 to 6 media assessment, that were highly predictive (R2>90%) of the PR:PROJECT_SUMMARY end-product phenotypes, specifically the total live CD4+ and CD8+ naïve and PR:PROJECT_SUMMARY central memory T cells (CD63L+CCR7+ cells), and the CD4+/CD8+ T cell ratio. This PR:PROJECT_SUMMARY generalizable workflow and computational platform could be broadly applied to PR:PROJECT_SUMMARY any cell-therapy manufacturing process to identify multivariate early CQAs and PR:PROJECT_SUMMARY CPPs that are predictable of final product quality. PR:INSTITUTE Georgia Institute of Technology;University of Puerto Rico Mayaguez PR:LAST_NAME Colonna PR:FIRST_NAME Maxwell PR:ADDRESS 315 Riverbend Rd, Athens, Georgia, 30602, USA PR:EMAIL maxwellbaca@uga.edu PR:PHONE 7065420257 PR:FUNDING_SOURCE NSF EEC-1648035 PR:PUBLICATIONS Predicting T Cell Quality During Manufacturing Through an AI-based Integrative PR:PUBLICATIONS Multi-omics Analytical Platform PR:CONTRIBUTORS Valerie Odeh-Couvertier, Nathan J. Dwarshuis, Maxwell B. Colonna, Bruce L. PR:CONTRIBUTORS Levine, Arthur S. Edison, Theresa Kotanchek, Krishnendu Roy, and Wandaliz PR:CONTRIBUTORS Torres-Garcia #STUDY ST:STUDY_TITLE Design of Experiments for Maximizing T cell endpoints ST:STUDY_SUMMARY Purified T cells from a single healthy donor were expanded in vitro with either ST:STUDY_SUMMARY magnetic beads or degradable micro-scaffold (DMS) particles. Magnetic bead ST:STUDY_SUMMARY cultures were expanded according to manufacturer’s instructions, while DMS ST:STUDY_SUMMARY cultures were expanded with varying DMS particle concentration, IL2 ST:STUDY_SUMMARY concentration, and antigen surface density on the particles, according to a ST:STUDY_SUMMARY design of experiments. Media of each culture of was sampled repeatedly over the ST:STUDY_SUMMARY course of a 14 day period. Quantities and characteristics of activated T cells ST:STUDY_SUMMARY were assessed at the end of the culture period, and media was analyzed by ST:STUDY_SUMMARY 1H-NMR. Analysis of spectra resulted in a set of 20 features that was used in ST:STUDY_SUMMARY predictive modeling of T cell endpoints, along with culture parameters described ST:STUDY_SUMMARY above and cytokine data. A second validation experiment was performed with ST:STUDY_SUMMARY different values for culture parameters, using the same culture, sampling, and ST:STUDY_SUMMARY NMR analysis methods. ST:INSTITUTE Georgia Institute of Technology ST:DEPARTMENT Complex Carbohydrate Research Center ST:LABORATORY Edison ST:LAST_NAME Colonna ST:FIRST_NAME Max ST:ADDRESS 315 Riverbend Rd ST:EMAIL maxwellbaca@uga.edu ST:PHONE 7065420257 ST:NUM_GROUPS 2 ST:TOTAL_SUBJECTS 1 #SUBJECT SU:SUBJECT_TYPE Cultured cells SU:SUBJECT_SPECIES Homo sapiens SU:TAXONOMY_ID 9606 SU:CELL_BIOSOURCE_OR_SUPPLIER Astarte Bio SU:CELL_STRAIN_DETAILS Cat 1017-3975JY18 #SUBJECT_SAMPLE_FACTORS: SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Raw file names and additional sample data SUBJECT_SAMPLE_FACTORS n/a batch1_1 method:Buffer_control | timepoint:n/a | il2_conc:n/a | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/1; batch=1; NMR_run_ID=1 SUBJECT_SAMPLE_FACTORS 20 batch1_2 method:Beads | timepoint:14 | il2_conc:20 | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/2; batch=1; NMR_run_ID=2 SUBJECT_SAMPLE_FACTORS 14 batch1_3 method:DMS | timepoint:6 | il2_conc:10 | carrier_conc:500 | abs_surface_density:60 RAW_FILE_NAME=batch1/3; batch=1; NMR_run_ID=3 SUBJECT_SAMPLE_FACTORS 13 batch1_4 method:DMS | timepoint:8 | il2_conc:30 | carrier_conc:1500 | abs_surface_density:80 RAW_FILE_NAME=batch1/4; batch=1; NMR_run_ID=4 SUBJECT_SAMPLE_FACTORS 16 batch1_5 method:DMS | timepoint:11 | il2_conc:10 | carrier_conc:500 | abs_surface_density:100 RAW_FILE_NAME=batch1/5; batch=1; NMR_run_ID=5 SUBJECT_SAMPLE_FACTORS 3 batch1_6 method:DMS | timepoint:11 | il2_conc:20 | carrier_conc:20 | abs_surface_density:20 RAW_FILE_NAME=batch1/6; batch=1; NMR_run_ID=6 SUBJECT_SAMPLE_FACTORS 4 batch1_7 method:DMS | timepoint:14 | il2_conc:20 | carrier_conc:20 | abs_surface_density:20 RAW_FILE_NAME=batch1/7; batch=1; NMR_run_ID=7 SUBJECT_SAMPLE_FACTORS 8 batch1_8 method:DMS | timepoint:8 | il2_conc:20 | carrier_conc:2500 | abs_surface_density:80 RAW_FILE_NAME=batch1/8; batch=1; NMR_run_ID=8 SUBJECT_SAMPLE_FACTORS 21 batch1_9 method:Beads | timepoint:8 | il2_conc:20 | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/9; batch=1; NMR_run_ID=9 SUBJECT_SAMPLE_FACTORS 7 batch1_10 method:DMS | timepoint:14 | il2_conc:10 | carrier_conc:2500 | abs_surface_density:60 RAW_FILE_NAME=batch1/10; batch=1; NMR_run_ID=10 SUBJECT_SAMPLE_FACTORS 19 batch1_11 method:Beads | timepoint:14 | il2_conc:20 | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/11; batch=1; NMR_run_ID=11 SUBJECT_SAMPLE_FACTORS 4 batch1_12 method:DMS | timepoint:6 | il2_conc:20 | carrier_conc:20 | abs_surface_density:20 RAW_FILE_NAME=batch1/12; batch=1; NMR_run_ID=12 SUBJECT_SAMPLE_FACTORS 18 batch1_13 method:DMS | timepoint:4 | il2_conc:30 | carrier_conc:2500 | abs_surface_density:60 RAW_FILE_NAME=batch1/13; batch=1; NMR_run_ID=13 SUBJECT_SAMPLE_FACTORS 12 batch1_14 method:DMS | timepoint:4 | il2_conc:10 | carrier_conc:1500 | abs_surface_density:80 RAW_FILE_NAME=batch1/14; batch=1; NMR_run_ID=14 SUBJECT_SAMPLE_FACTORS 10 batch1_15 method:DMS | timepoint:14 | il2_conc:10 | carrier_conc:2500 | abs_surface_density:100 RAW_FILE_NAME=batch1/15; batch=1; NMR_run_ID=15 SUBJECT_SAMPLE_FACTORS 10 batch1_16 method:DMS | timepoint:11 | il2_conc:10 | carrier_conc:2500 | abs_surface_density:100 RAW_FILE_NAME=batch1/16; batch=1; NMR_run_ID=16 SUBJECT_SAMPLE_FACTORS 4 batch1_17 method:DMS | timepoint:4 | il2_conc:20 | carrier_conc:20 | abs_surface_density:20 RAW_FILE_NAME=batch1/17; batch=1; NMR_run_ID=17 SUBJECT_SAMPLE_FACTORS 19 batch1_18 method:Beads | timepoint:8 | il2_conc:20 | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/18; batch=1; NMR_run_ID=18 SUBJECT_SAMPLE_FACTORS 16 batch1_19 method:DMS | timepoint:4 | il2_conc:10 | carrier_conc:500 | abs_surface_density:100 RAW_FILE_NAME=batch1/19; batch=1; NMR_run_ID=19 SUBJECT_SAMPLE_FACTORS 21 batch1_20 method:Beads | timepoint:14 | il2_conc:20 | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/20; batch=1; NMR_run_ID=20 SUBJECT_SAMPLE_FACTORS 6 batch1_21 method:DMS | timepoint:11 | il2_conc:30 | carrier_conc:2500 | abs_surface_density:100 RAW_FILE_NAME=batch1/21; batch=1; NMR_run_ID=21 SUBJECT_SAMPLE_FACTORS 9 batch1_22 method:DMS | timepoint:4 | il2_conc:20 | carrier_conc:500 | abs_surface_density:80 RAW_FILE_NAME=batch1/22; batch=1; NMR_run_ID=22 SUBJECT_SAMPLE_FACTORS 2 batch1_23 method:DMS | timepoint:4 | il2_conc:20 | carrier_conc:2500 | abs_surface_density:80 RAW_FILE_NAME=batch1/23; batch=1; NMR_run_ID=23 SUBJECT_SAMPLE_FACTORS n/a batch1_24 method:Internal_control | timepoint:n/a | il2_conc:n/a | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/24; batch=1; NMR_run_ID=24 SUBJECT_SAMPLE_FACTORS 16 batch1_25 method:DMS | timepoint:6 | il2_conc:10 | carrier_conc:500 | abs_surface_density:100 RAW_FILE_NAME=batch1/25; batch=1; NMR_run_ID=25 SUBJECT_SAMPLE_FACTORS 19 batch1_26 method:Beads | timepoint:4 | il2_conc:20 | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/26; batch=1; NMR_run_ID=26 SUBJECT_SAMPLE_FACTORS 1 batch1_27 method:DMS | timepoint:11 | il2_conc:30 | carrier_conc:500 | abs_surface_density:100 RAW_FILE_NAME=batch1/27; batch=1; NMR_run_ID=27 SUBJECT_SAMPLE_FACTORS 22 batch1_28 method:Beads | timepoint:4 | il2_conc:20 | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/28; batch=1; NMR_run_ID=28 SUBJECT_SAMPLE_FACTORS 6 batch1_29 method:DMS | timepoint:6 | il2_conc:30 | carrier_conc:2500 | abs_surface_density:100 RAW_FILE_NAME=batch1/29; batch=1; NMR_run_ID=29 SUBJECT_SAMPLE_FACTORS 7 batch1_30 method:DMS | timepoint:8 | il2_conc:10 | carrier_conc:2500 | abs_surface_density:60 RAW_FILE_NAME=batch1/30; batch=1; NMR_run_ID=30 SUBJECT_SAMPLE_FACTORS 23 batch1_31 method:Beads | timepoint:6 | il2_conc:20 | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/31; batch=1; NMR_run_ID=31 SUBJECT_SAMPLE_FACTORS 22 batch1_32 method:Beads | timepoint:11 | il2_conc:20 | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/32; batch=1; NMR_run_ID=32 SUBJECT_SAMPLE_FACTORS 15 batch1_33 method:DMS | timepoint:11 | il2_conc:30 | carrier_conc:500 | abs_surface_density:60 RAW_FILE_NAME=batch1/33; batch=1; NMR_run_ID=33 SUBJECT_SAMPLE_FACTORS 17 batch1_34 method:DMS | timepoint:11 | il2_conc:20 | carrier_conc:1500 | abs_surface_density:60 RAW_FILE_NAME=batch1/34; batch=1; NMR_run_ID=34 SUBJECT_SAMPLE_FACTORS 8 batch1_35 method:DMS | timepoint:4 | il2_conc:20 | carrier_conc:2500 | abs_surface_density:80 RAW_FILE_NAME=batch1/35; batch=1; NMR_run_ID=35 SUBJECT_SAMPLE_FACTORS 23 batch1_36 method:Beads | timepoint:14 | il2_conc:20 | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/36; batch=1; NMR_run_ID=36 SUBJECT_SAMPLE_FACTORS 8 batch1_37 method:DMS | timepoint:11 | il2_conc:20 | carrier_conc:2500 | abs_surface_density:80 RAW_FILE_NAME=batch1/37; batch=1; NMR_run_ID=37 SUBJECT_SAMPLE_FACTORS n/a batch1_38 method:Internal_control | timepoint:n/a | il2_conc:n/a | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/38; batch=1; NMR_run_ID=38 SUBJECT_SAMPLE_FACTORS 21 batch1_39 method:Beads | timepoint:4 | il2_conc:20 | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/39; batch=1; NMR_run_ID=39 SUBJECT_SAMPLE_FACTORS 14 batch1_40 method:DMS | timepoint:11 | il2_conc:10 | carrier_conc:500 | abs_surface_density:60 RAW_FILE_NAME=batch1/40; batch=1; NMR_run_ID=40 SUBJECT_SAMPLE_FACTORS 11 batch1_41 method:DMS | timepoint:6 | il2_conc:30 | carrier_conc:1500 | abs_surface_density:80 RAW_FILE_NAME=batch1/41; batch=1; NMR_run_ID=41 SUBJECT_SAMPLE_FACTORS 15 batch1_42 method:DMS | timepoint:4 | il2_conc:30 | carrier_conc:500 | abs_surface_density:60 RAW_FILE_NAME=batch1/42; batch=1; NMR_run_ID=42 SUBJECT_SAMPLE_FACTORS 13 batch1_43 method:DMS | timepoint:14 | il2_conc:30 | carrier_conc:1500 | abs_surface_density:80 RAW_FILE_NAME=batch1/43; batch=1; NMR_run_ID=43 SUBJECT_SAMPLE_FACTORS 13 batch1_44 method:DMS | timepoint:6 | il2_conc:30 | carrier_conc:1500 | abs_surface_density:80 RAW_FILE_NAME=batch1/44; batch=1; NMR_run_ID=44 SUBJECT_SAMPLE_FACTORS 21 batch1_45 method:Beads | timepoint:6 | il2_conc:20 | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/45; batch=1; NMR_run_ID=45 SUBJECT_SAMPLE_FACTORS 8 batch1_46 method:DMS | timepoint:6 | il2_conc:20 | carrier_conc:2500 | abs_surface_density:80 RAW_FILE_NAME=batch1/46; batch=1; NMR_run_ID=46 SUBJECT_SAMPLE_FACTORS 17 batch1_47 method:DMS | timepoint:6 | il2_conc:20 | carrier_conc:1500 | abs_surface_density:60 RAW_FILE_NAME=batch1/47; batch=1; NMR_run_ID=47 SUBJECT_SAMPLE_FACTORS n/a batch1_48 method:Buffer_control | timepoint:n/a | il2_conc:n/a | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/48; batch=1; NMR_run_ID=48 SUBJECT_SAMPLE_FACTORS 18 batch1_49 method:DMS | timepoint:14 | il2_conc:30 | carrier_conc:2500 | abs_surface_density:60 RAW_FILE_NAME=batch1/49; batch=1; NMR_run_ID=49 SUBJECT_SAMPLE_FACTORS 15 batch1_50 method:DMS | timepoint:8 | il2_conc:30 | carrier_conc:500 | abs_surface_density:60 RAW_FILE_NAME=batch1/50; batch=1; NMR_run_ID=50 SUBJECT_SAMPLE_FACTORS 24 batch1_51 method:Beads | timepoint:6 | il2_conc:20 | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/51; batch=1; NMR_run_ID=51 SUBJECT_SAMPLE_FACTORS 12 batch1_52 method:DMS | timepoint:14 | il2_conc:10 | carrier_conc:1500 | abs_surface_density:80 RAW_FILE_NAME=batch1/52; batch=1; NMR_run_ID=52 SUBJECT_SAMPLE_FACTORS 14 batch1_53 method:DMS | timepoint:4 | il2_conc:10 | carrier_conc:500 | abs_surface_density:60 RAW_FILE_NAME=batch1/53; batch=1; NMR_run_ID=53 SUBJECT_SAMPLE_FACTORS 13 batch1_54 method:DMS | timepoint:4 | il2_conc:30 | carrier_conc:1500 | abs_surface_density:80 RAW_FILE_NAME=batch1/54; batch=1; NMR_run_ID=54 SUBJECT_SAMPLE_FACTORS 5 batch1_55 method:DMS | timepoint:14 | il2_conc:20 | carrier_conc:1500 | abs_surface_density:100 RAW_FILE_NAME=batch1/55; batch=1; NMR_run_ID=55 SUBJECT_SAMPLE_FACTORS 12 batch1_57 method:DMS | timepoint:8 | il2_conc:10 | carrier_conc:1500 | abs_surface_density:80 RAW_FILE_NAME=batch1/57; batch=1; NMR_run_ID=57 SUBJECT_SAMPLE_FACTORS 1 batch1_58 method:DMS | timepoint:8 | il2_conc:30 | carrier_conc:500 | abs_surface_density:100 RAW_FILE_NAME=batch1/58; batch=1; NMR_run_ID=58 SUBJECT_SAMPLE_FACTORS 20 batch1_59 method:Beads | timepoint:8 | il2_conc:20 | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/59; batch=1; NMR_run_ID=59 SUBJECT_SAMPLE_FACTORS 9 batch1_60 method:DMS | timepoint:6 | il2_conc:20 | carrier_conc:500 | abs_surface_density:80 RAW_FILE_NAME=batch1/60; batch=1; NMR_run_ID=60 SUBJECT_SAMPLE_FACTORS 8 batch1_61 method:DMS | timepoint:14 | il2_conc:20 | carrier_conc:2500 | abs_surface_density:80 RAW_FILE_NAME=batch1/61; batch=1; NMR_run_ID=61 SUBJECT_SAMPLE_FACTORS 23 batch1_62 method:Beads | timepoint:8 | il2_conc:20 | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/62; batch=1; NMR_run_ID=62 SUBJECT_SAMPLE_FACTORS 23 batch1_63 method:Beads | timepoint:4 | il2_conc:20 | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/63; batch=1; NMR_run_ID=63 SUBJECT_SAMPLE_FACTORS 6 batch1_64 method:DMS | timepoint:14 | il2_conc:30 | carrier_conc:2500 | abs_surface_density:100 RAW_FILE_NAME=batch1/64; batch=1; NMR_run_ID=64 SUBJECT_SAMPLE_FACTORS 19 batch1_65 method:Beads | timepoint:6 | il2_conc:20 | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/65; batch=1; NMR_run_ID=65 SUBJECT_SAMPLE_FACTORS 17 batch1_66 method:DMS | timepoint:8 | il2_conc:20 | carrier_conc:1500 | abs_surface_density:60 RAW_FILE_NAME=batch1/66; batch=1; NMR_run_ID=66 SUBJECT_SAMPLE_FACTORS 19 batch1_67 method:Beads | timepoint:11 | il2_conc:20 | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/67; batch=1; NMR_run_ID=67 SUBJECT_SAMPLE_FACTORS 18 batch1_68 method:DMS | timepoint:8 | il2_conc:30 | carrier_conc:2500 | abs_surface_density:60 RAW_FILE_NAME=batch1/68; batch=1; NMR_run_ID=68 SUBJECT_SAMPLE_FACTORS 6 batch1_69 method:DMS | timepoint:4 | il2_conc:30 | carrier_conc:2500 | abs_surface_density:100 RAW_FILE_NAME=batch1/69; batch=1; NMR_run_ID=69 SUBJECT_SAMPLE_FACTORS 5 batch1_70 method:DMS | timepoint:11 | il2_conc:20 | carrier_conc:1500 | abs_surface_density:100 RAW_FILE_NAME=batch1/70; batch=1; NMR_run_ID=70 SUBJECT_SAMPLE_FACTORS 10 batch1_71 method:DMS | timepoint:6 | il2_conc:10 | carrier_conc:2500 | abs_surface_density:100 RAW_FILE_NAME=batch1/71; batch=1; NMR_run_ID=71 SUBJECT_SAMPLE_FACTORS 21 batch1_72 method:Beads | timepoint:11 | il2_conc:20 | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/72; batch=1; NMR_run_ID=72 SUBJECT_SAMPLE_FACTORS n/a batch1_73 method:Internal_control | timepoint:n/a | il2_conc:n/a | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/73; batch=1; NMR_run_ID=73 SUBJECT_SAMPLE_FACTORS 16 batch1_74 method:DMS | timepoint:14 | il2_conc:10 | carrier_conc:500 | abs_surface_density:100 RAW_FILE_NAME=batch1/74; batch=1; NMR_run_ID=74 SUBJECT_SAMPLE_FACTORS 7 batch1_75 method:DMS | timepoint:6 | il2_conc:10 | carrier_conc:2500 | abs_surface_density:60 RAW_FILE_NAME=batch1/75; batch=1; NMR_run_ID=75 SUBJECT_SAMPLE_FACTORS 18 batch1_76 method:DMS | timepoint:6 | il2_conc:30 | carrier_conc:2500 | abs_surface_density:60 RAW_FILE_NAME=batch1/76; batch=1; NMR_run_ID=76 SUBJECT_SAMPLE_FACTORS 14 batch1_77 method:DMS | timepoint:8 | il2_conc:10 | carrier_conc:500 | abs_surface_density:60 RAW_FILE_NAME=batch1/77; batch=1; NMR_run_ID=77 SUBJECT_SAMPLE_FACTORS 22 batch1_78 method:Beads | timepoint:14 | il2_conc:20 | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/78; batch=1; NMR_run_ID=78 SUBJECT_SAMPLE_FACTORS 4 batch1_79 method:DMS | timepoint:11 | il2_conc:20 | carrier_conc:20 | abs_surface_density:20 RAW_FILE_NAME=batch1/79; batch=1; NMR_run_ID=79 SUBJECT_SAMPLE_FACTORS 3 batch1_80 method:DMS | timepoint:4 | il2_conc:20 | carrier_conc:20 | abs_surface_density:20 RAW_FILE_NAME=batch1/80; batch=1; NMR_run_ID=80 SUBJECT_SAMPLE_FACTORS 16 batch1_81 method:DMS | timepoint:8 | il2_conc:10 | carrier_conc:500 | abs_surface_density:100 RAW_FILE_NAME=batch1/81; batch=1; NMR_run_ID=81 SUBJECT_SAMPLE_FACTORS 13 batch1_82 method:DMS | timepoint:11 | il2_conc:30 | carrier_conc:1500 | abs_surface_density:80 RAW_FILE_NAME=batch1/82; batch=1; NMR_run_ID=82 SUBJECT_SAMPLE_FACTORS 6 batch1_83 method:DMS | timepoint:8 | il2_conc:30 | carrier_conc:2500 | abs_surface_density:100 RAW_FILE_NAME=batch1/83; batch=1; NMR_run_ID=83 SUBJECT_SAMPLE_FACTORS 3 batch1_84 method:DMS | timepoint:14 | il2_conc:20 | carrier_conc:20 | abs_surface_density:20 RAW_FILE_NAME=batch1/84; batch=1; NMR_run_ID=84 SUBJECT_SAMPLE_FACTORS 4 batch1_85 method:DMS | timepoint:8 | il2_conc:20 | carrier_conc:20 | abs_surface_density:20 RAW_FILE_NAME=batch1/85; batch=1; NMR_run_ID=85 SUBJECT_SAMPLE_FACTORS 1 batch1_86 method:DMS | timepoint:6 | il2_conc:30 | carrier_conc:500 | abs_surface_density:100 RAW_FILE_NAME=batch1/86; batch=1; NMR_run_ID=86 SUBJECT_SAMPLE_FACTORS 11 batch1_87 method:DMS | timepoint:8 | il2_conc:30 | carrier_conc:1500 | abs_surface_density:80 RAW_FILE_NAME=batch1/87; batch=1; NMR_run_ID=87 SUBJECT_SAMPLE_FACTORS 9 batch1_88 method:DMS | timepoint:14 | il2_conc:20 | carrier_conc:500 | abs_surface_density:80 RAW_FILE_NAME=batch1/88; batch=1; NMR_run_ID=88 SUBJECT_SAMPLE_FACTORS 7 batch1_89 method:DMS | timepoint:11 | il2_conc:10 | carrier_conc:2500 | abs_surface_density:60 RAW_FILE_NAME=batch1/89; batch=1; NMR_run_ID=89 SUBJECT_SAMPLE_FACTORS 18 batch1_90 method:DMS | timepoint:11 | il2_conc:30 | carrier_conc:2500 | abs_surface_density:60 RAW_FILE_NAME=batch1/90; batch=1; NMR_run_ID=90 SUBJECT_SAMPLE_FACTORS 15 batch1_91 method:DMS | timepoint:14 | il2_conc:30 | carrier_conc:500 | abs_surface_density:60 RAW_FILE_NAME=batch1/91; batch=1; NMR_run_ID=91 SUBJECT_SAMPLE_FACTORS 20 batch1_92 method:Beads | timepoint:11 | il2_conc:20 | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/92; batch=1; NMR_run_ID=92 SUBJECT_SAMPLE_FACTORS 10 batch1_93 method:DMS | timepoint:8 | il2_conc:10 | carrier_conc:2500 | abs_surface_density:100 RAW_FILE_NAME=batch1/93; batch=1; NMR_run_ID=93 SUBJECT_SAMPLE_FACTORS 15 batch1_94 method:DMS | timepoint:6 | il2_conc:30 | carrier_conc:500 | abs_surface_density:60 RAW_FILE_NAME=batch1/94; batch=1; NMR_run_ID=94 SUBJECT_SAMPLE_FACTORS 2 batch1_95 method:DMS | timepoint:6 | il2_conc:20 | carrier_conc:2500 | abs_surface_density:80 RAW_FILE_NAME=batch1/95; batch=1; NMR_run_ID=95 SUBJECT_SAMPLE_FACTORS n/a batch1_96 method:Buffer_control | timepoint:n/a | il2_conc:n/a | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/96; batch=1; NMR_run_ID=96 SUBJECT_SAMPLE_FACTORS 5 batch1_98 method:DMS | timepoint:4 | il2_conc:20 | carrier_conc:1500 | abs_surface_density:100 RAW_FILE_NAME=batch1/98; batch=1; NMR_run_ID=98 SUBJECT_SAMPLE_FACTORS 3 batch1_100 method:DMS | timepoint:8 | il2_conc:20 | carrier_conc:20 | abs_surface_density:20 RAW_FILE_NAME=batch1/100; batch=1; NMR_run_ID=100 SUBJECT_SAMPLE_FACTORS 24 batch1_101 method:Beads | timepoint:4 | il2_conc:20 | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/101; batch=1; NMR_run_ID=101 SUBJECT_SAMPLE_FACTORS 7 batch1_102 method:DMS | timepoint:4 | il2_conc:10 | carrier_conc:2500 | abs_surface_density:60 RAW_FILE_NAME=batch1/102; batch=1; NMR_run_ID=102 SUBJECT_SAMPLE_FACTORS 24 batch1_103 method:Beads | timepoint:11 | il2_conc:20 | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/103; batch=1; NMR_run_ID=103 SUBJECT_SAMPLE_FACTORS 1 batch1_104 method:DMS | timepoint:4 | il2_conc:30 | carrier_conc:500 | abs_surface_density:100 RAW_FILE_NAME=batch1/104; batch=1; NMR_run_ID=104 SUBJECT_SAMPLE_FACTORS 5 batch1_105 method:DMS | timepoint:6 | il2_conc:20 | carrier_conc:1500 | abs_surface_density:100 RAW_FILE_NAME=batch1/105; batch=1; NMR_run_ID=105 SUBJECT_SAMPLE_FACTORS 2 batch1_106 method:DMS | timepoint:11 | il2_conc:20 | carrier_conc:2500 | abs_surface_density:80 RAW_FILE_NAME=batch1/106; batch=1; NMR_run_ID=106 SUBJECT_SAMPLE_FACTORS 14 batch1_107 method:DMS | timepoint:14 | il2_conc:10 | carrier_conc:500 | abs_surface_density:60 RAW_FILE_NAME=batch1/107; batch=1; NMR_run_ID=107 SUBJECT_SAMPLE_FACTORS 24 batch1_108 method:Beads | timepoint:8 | il2_conc:20 | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/108; batch=1; NMR_run_ID=108 SUBJECT_SAMPLE_FACTORS 17 batch1_109 method:DMS | timepoint:14 | il2_conc:20 | carrier_conc:1500 | abs_surface_density:60 RAW_FILE_NAME=batch1/109; batch=1; NMR_run_ID=109 SUBJECT_SAMPLE_FACTORS 9 batch1_110 method:DMS | timepoint:11 | il2_conc:20 | carrier_conc:500 | abs_surface_density:80 RAW_FILE_NAME=batch1/110; batch=1; NMR_run_ID=110 SUBJECT_SAMPLE_FACTORS 12 batch1_111 method:DMS | timepoint:6 | il2_conc:10 | carrier_conc:1500 | abs_surface_density:80 RAW_FILE_NAME=batch1/111; batch=1; NMR_run_ID=111 SUBJECT_SAMPLE_FACTORS 11 batch1_112 method:DMS | timepoint:11 | il2_conc:30 | carrier_conc:1500 | abs_surface_density:80 RAW_FILE_NAME=batch1/112; batch=1; NMR_run_ID=112 SUBJECT_SAMPLE_FACTORS 11 batch1_113 method:DMS | timepoint:4 | il2_conc:30 | carrier_conc:1500 | abs_surface_density:80 RAW_FILE_NAME=batch1/113; batch=1; NMR_run_ID=113 SUBJECT_SAMPLE_FACTORS n/a batch1_114 method:Internal_control | timepoint:n/a | il2_conc:n/a | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/114; batch=1; NMR_run_ID=114 SUBJECT_SAMPLE_FACTORS 3 batch1_115 method:DMS | timepoint:6 | il2_conc:20 | carrier_conc:20 | abs_surface_density:20 RAW_FILE_NAME=batch1/115; batch=1; NMR_run_ID=115 SUBJECT_SAMPLE_FACTORS 22 batch1_116 method:Beads | timepoint:6 | il2_conc:20 | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/116; batch=1; NMR_run_ID=116 SUBJECT_SAMPLE_FACTORS 20 batch1_117 method:Beads | timepoint:6 | il2_conc:20 | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/117; batch=1; NMR_run_ID=117 SUBJECT_SAMPLE_FACTORS 23 batch1_118 method:Beads | timepoint:11 | il2_conc:20 | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/118; batch=1; NMR_run_ID=118 SUBJECT_SAMPLE_FACTORS 20 batch1_119 method:Beads | timepoint:4 | il2_conc:20 | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/119; batch=1; NMR_run_ID=119 SUBJECT_SAMPLE_FACTORS 1 batch1_120 method:DMS | timepoint:14 | il2_conc:30 | carrier_conc:500 | abs_surface_density:100 RAW_FILE_NAME=batch1/120; batch=1; NMR_run_ID=120 SUBJECT_SAMPLE_FACTORS 10 batch1_121 method:DMS | timepoint:4 | il2_conc:10 | carrier_conc:2500 | abs_surface_density:100 RAW_FILE_NAME=batch1/121; batch=1; NMR_run_ID=121 SUBJECT_SAMPLE_FACTORS 2 batch1_122 method:DMS | timepoint:8 | il2_conc:20 | carrier_conc:2500 | abs_surface_density:80 RAW_FILE_NAME=batch1/122; batch=1; NMR_run_ID=122 SUBJECT_SAMPLE_FACTORS 22 batch1_123 method:Beads | timepoint:8 | il2_conc:20 | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/123; batch=1; NMR_run_ID=123 SUBJECT_SAMPLE_FACTORS 2 batch1_124 method:DMS | timepoint:14 | il2_conc:20 | carrier_conc:2500 | abs_surface_density:80 RAW_FILE_NAME=batch1/124; batch=1; NMR_run_ID=124 SUBJECT_SAMPLE_FACTORS 17 batch1_125 method:DMS | timepoint:4 | il2_conc:20 | carrier_conc:1500 | abs_surface_density:60 RAW_FILE_NAME=batch1/125; batch=1; NMR_run_ID=125 SUBJECT_SAMPLE_FACTORS 9 batch1_126 method:DMS | timepoint:8 | il2_conc:20 | carrier_conc:500 | abs_surface_density:80 RAW_FILE_NAME=batch1/126; batch=1; NMR_run_ID=126 SUBJECT_SAMPLE_FACTORS 5 batch1_127 method:DMS | timepoint:8 | il2_conc:20 | carrier_conc:1500 | abs_surface_density:100 RAW_FILE_NAME=batch1/127; batch=1; NMR_run_ID=127 SUBJECT_SAMPLE_FACTORS 12 batch1_128 method:DMS | timepoint:11 | il2_conc:10 | carrier_conc:1500 | abs_surface_density:80 RAW_FILE_NAME=batch1/128; batch=1; NMR_run_ID=128 SUBJECT_SAMPLE_FACTORS 11 batch1_129 method:DMS | timepoint:14 | il2_conc:30 | carrier_conc:1500 | abs_surface_density:80 RAW_FILE_NAME=batch1/129; batch=1; NMR_run_ID=129 SUBJECT_SAMPLE_FACTORS n/a batch1_130 method:Buffer_control_last | timepoint:n/a | il2_conc:n/a | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch1/130; batch=1; NMR_run_ID=130 SUBJECT_SAMPLE_FACTORS n/a batch2_1 method:Buffer_control | timepoint:n/a | il2_conc:n/a | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch2/1; batch=2; NMR_run_ID=1 SUBJECT_SAMPLE_FACTORS 18 batch2_2 method:DMS | timepoint:6 | il2_conc:40 | carrier_conc:3500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/2; batch=2; NMR_run_ID=2 SUBJECT_SAMPLE_FACTORS 6 batch2_3 method:DMS | timepoint:14 | il2_conc:40 | carrier_conc:1500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/3; batch=2; NMR_run_ID=3 SUBJECT_SAMPLE_FACTORS 19 batch2_4 method:DMS | timepoint:11 | il2_conc:40 | carrier_conc:2500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/4; batch=2; NMR_run_ID=4 SUBJECT_SAMPLE_FACTORS 17 batch2_5 method:DMS | timepoint:4 | il2_conc:35 | carrier_conc:3000 | abs_surface_density:1282 RAW_FILE_NAME=batch2/5; batch=2; NMR_run_ID=5 SUBJECT_SAMPLE_FACTORS 2 batch2_6 method:DMS | timepoint:6 | il2_conc:35 | carrier_conc:2000 | abs_surface_density:1282 RAW_FILE_NAME=batch2/6; batch=2; NMR_run_ID=6 SUBJECT_SAMPLE_FACTORS 9 batch2_7 method:DMS | timepoint:11 | il2_conc:35 | carrier_conc:1000 | abs_surface_density:1729 RAW_FILE_NAME=batch2/7; batch=2; NMR_run_ID=7 SUBJECT_SAMPLE_FACTORS 10 batch2_8 method:DMS | timepoint:4 | il2_conc:30 | carrier_conc:1500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/8; batch=2; NMR_run_ID=8 SUBJECT_SAMPLE_FACTORS n/a batch2_9 method:Internal_control | timepoint:n/a | il2_conc:n/a | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch2/9; batch=2; NMR_run_ID=9 SUBJECT_SAMPLE_FACTORS 11 batch2_10 method:DMS | timepoint:4 | il2_conc:35 | carrier_conc:3000 | abs_surface_density:1729 RAW_FILE_NAME=batch2/10; batch=2; NMR_run_ID=10 SUBJECT_SAMPLE_FACTORS 18 batch2_11 method:DMS | timepoint:8 | il2_conc:40 | carrier_conc:3500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/11; batch=2; NMR_run_ID=11 SUBJECT_SAMPLE_FACTORS 7 batch2_12 method:DMS | timepoint:4 | il2_conc:30 | carrier_conc:500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/12; batch=2; NMR_run_ID=12 SUBJECT_SAMPLE_FACTORS 20 batch2_13 method:DMS | timepoint:14 | il2_conc:40 | carrier_conc:3500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/13; batch=2; NMR_run_ID=13 SUBJECT_SAMPLE_FACTORS 2 batch2_14 method:DMS | timepoint:11 | il2_conc:35 | carrier_conc:2000 | abs_surface_density:1282 RAW_FILE_NAME=batch2/14; batch=2; NMR_run_ID=14 SUBJECT_SAMPLE_FACTORS 7 batch2_15 method:DMS | timepoint:11 | il2_conc:30 | carrier_conc:500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/15; batch=2; NMR_run_ID=15 SUBJECT_SAMPLE_FACTORS 17 batch2_16 method:DMS | timepoint:6 | il2_conc:35 | carrier_conc:3000 | abs_surface_density:1282 RAW_FILE_NAME=batch2/16; batch=2; NMR_run_ID=16 SUBJECT_SAMPLE_FACTORS 16 batch2_17 method:DMS | timepoint:14 | il2_conc:35 | carrier_conc:1000 | abs_surface_density:1282 RAW_FILE_NAME=batch2/17; batch=2; NMR_run_ID=17 SUBJECT_SAMPLE_FACTORS 1 batch2_18 method:DMS | timepoint:8 | il2_conc:40 | carrier_conc:500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/18; batch=2; NMR_run_ID=18 SUBJECT_SAMPLE_FACTORS 6 batch2_19 method:DMS | timepoint:6 | il2_conc:40 | carrier_conc:1500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/19; batch=2; NMR_run_ID=19 SUBJECT_SAMPLE_FACTORS 3 batch2_20 method:DMS | timepoint:11 | il2_conc:30 | carrier_conc:1500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/20; batch=2; NMR_run_ID=20 SUBJECT_SAMPLE_FACTORS 10 batch2_21 method:DMS | timepoint:11 | il2_conc:30 | carrier_conc:1500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/21; batch=2; NMR_run_ID=21 SUBJECT_SAMPLE_FACTORS 3 batch2_22 method:DMS | timepoint:8 | il2_conc:30 | carrier_conc:1500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/22; batch=2; NMR_run_ID=22 SUBJECT_SAMPLE_FACTORS 20 batch2_23 method:DMS | timepoint:8 | il2_conc:40 | carrier_conc:3500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/23; batch=2; NMR_run_ID=23 SUBJECT_SAMPLE_FACTORS 19 batch2_24 method:DMS | timepoint:6 | il2_conc:40 | carrier_conc:2500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/24; batch=2; NMR_run_ID=24 SUBJECT_SAMPLE_FACTORS 15 batch2_25 method:DMS | timepoint:4 | il2_conc:30 | carrier_conc:500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/25; batch=2; NMR_run_ID=25 SUBJECT_SAMPLE_FACTORS 6 batch2_26 method:DMS | timepoint:4 | il2_conc:40 | carrier_conc:1500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/26; batch=2; NMR_run_ID=26 SUBJECT_SAMPLE_FACTORS 8 batch2_27 method:DMS | timepoint:8 | il2_conc:35 | carrier_conc:2000 | abs_surface_density:1729 RAW_FILE_NAME=batch2/27; batch=2; NMR_run_ID=27 SUBJECT_SAMPLE_FACTORS 5 batch2_28 method:DMS | timepoint:8 | il2_conc:40 | carrier_conc:2500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/28; batch=2; NMR_run_ID=28 SUBJECT_SAMPLE_FACTORS 20 batch2_29 method:DMS | timepoint:4 | il2_conc:40 | carrier_conc:3500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/29; batch=2; NMR_run_ID=29 SUBJECT_SAMPLE_FACTORS 8 batch2_30 method:DMS | timepoint:4 | il2_conc:35 | carrier_conc:2000 | abs_surface_density:1729 RAW_FILE_NAME=batch2/30; batch=2; NMR_run_ID=30 SUBJECT_SAMPLE_FACTORS 14 batch2_31 method:DMS | timepoint:8 | il2_conc:40 | carrier_conc:500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/31; batch=2; NMR_run_ID=31 SUBJECT_SAMPLE_FACTORS 17 batch2_32 method:DMS | timepoint:11 | il2_conc:35 | carrier_conc:3000 | abs_surface_density:1282 RAW_FILE_NAME=batch2/32; batch=2; NMR_run_ID=32 SUBJECT_SAMPLE_FACTORS n/a batch2_33 method:Internal_control | timepoint:n/a | il2_conc:n/a | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch2/33; batch=2; NMR_run_ID=33 SUBJECT_SAMPLE_FACTORS 7 batch2_34 method:DMS | timepoint:8 | il2_conc:30 | carrier_conc:500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/34; batch=2; NMR_run_ID=34 SUBJECT_SAMPLE_FACTORS 13 batch2_35 method:DMS | timepoint:4 | il2_conc:40 | carrier_conc:1500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/35; batch=2; NMR_run_ID=35 SUBJECT_SAMPLE_FACTORS 11 batch2_36 method:DMS | timepoint:6 | il2_conc:35 | carrier_conc:3000 | abs_surface_density:1729 RAW_FILE_NAME=batch2/36; batch=2; NMR_run_ID=36 SUBJECT_SAMPLE_FACTORS 4 batch2_37 method:DMS | timepoint:14 | il2_conc:30 | carrier_conc:2500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/37; batch=2; NMR_run_ID=37 SUBJECT_SAMPLE_FACTORS 1 batch2_38 method:DMS | timepoint:14 | il2_conc:40 | carrier_conc:500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/38; batch=2; NMR_run_ID=38 SUBJECT_SAMPLE_FACTORS 12 batch2_39 method:DMS | timepoint:6 | il2_conc:30 | carrier_conc:2500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/39; batch=2; NMR_run_ID=39 SUBJECT_SAMPLE_FACTORS 5 batch2_40 method:DMS | timepoint:11 | il2_conc:40 | carrier_conc:2500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/40; batch=2; NMR_run_ID=40 SUBJECT_SAMPLE_FACTORS 13 batch2_41 method:DMS | timepoint:6 | il2_conc:40 | carrier_conc:1500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/41; batch=2; NMR_run_ID=41 SUBJECT_SAMPLE_FACTORS 10 batch2_42 method:DMS | timepoint:8 | il2_conc:30 | carrier_conc:1500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/42; batch=2; NMR_run_ID=42 SUBJECT_SAMPLE_FACTORS 9 batch2_43 method:DMS | timepoint:14 | il2_conc:35 | carrier_conc:1000 | abs_surface_density:1729 RAW_FILE_NAME=batch2/43; batch=2; NMR_run_ID=43 SUBJECT_SAMPLE_FACTORS 11 batch2_44 method:DMS | timepoint:14 | il2_conc:35 | carrier_conc:3000 | abs_surface_density:1729 RAW_FILE_NAME=batch2/44; batch=2; NMR_run_ID=44 SUBJECT_SAMPLE_FACTORS 4 batch2_45 method:DMS | timepoint:8 | il2_conc:30 | carrier_conc:2500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/45; batch=2; NMR_run_ID=45 SUBJECT_SAMPLE_FACTORS 16 batch2_46 method:DMS | timepoint:11 | il2_conc:35 | carrier_conc:1000 | abs_surface_density:1282 RAW_FILE_NAME=batch2/46; batch=2; NMR_run_ID=46 SUBJECT_SAMPLE_FACTORS 12 batch2_47 method:DMS | timepoint:8 | il2_conc:30 | carrier_conc:2500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/47; batch=2; NMR_run_ID=47 SUBJECT_SAMPLE_FACTORS n/a batch2_48 method:Buffer_control | timepoint:n/a | il2_conc:n/a | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch2/48; batch=2; NMR_run_ID=48 SUBJECT_SAMPLE_FACTORS 19 batch2_49 method:DMS | timepoint:14 | il2_conc:40 | carrier_conc:2500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/49; batch=2; NMR_run_ID=49 SUBJECT_SAMPLE_FACTORS 10 batch2_50 method:DMS | timepoint:14 | il2_conc:30 | carrier_conc:1500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/50; batch=2; NMR_run_ID=50 SUBJECT_SAMPLE_FACTORS 6 batch2_51 method:DMS | timepoint:8 | il2_conc:40 | carrier_conc:1500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/51; batch=2; NMR_run_ID=51 SUBJECT_SAMPLE_FACTORS 2 batch2_52 method:DMS | timepoint:14 | il2_conc:35 | carrier_conc:2000 | abs_surface_density:1282 RAW_FILE_NAME=batch2/52; batch=2; NMR_run_ID=52 SUBJECT_SAMPLE_FACTORS 14 batch2_53 method:DMS | timepoint:14 | il2_conc:40 | carrier_conc:500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/53; batch=2; NMR_run_ID=53 SUBJECT_SAMPLE_FACTORS 14 batch2_54 method:DMS | timepoint:11 | il2_conc:40 | carrier_conc:500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/54; batch=2; NMR_run_ID=54 SUBJECT_SAMPLE_FACTORS 18 batch2_55 method:DMS | timepoint:14 | il2_conc:40 | carrier_conc:3500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/55; batch=2; NMR_run_ID=55 SUBJECT_SAMPLE_FACTORS 8 batch2_56 method:DMS | timepoint:6 | il2_conc:35 | carrier_conc:2000 | abs_surface_density:1729 RAW_FILE_NAME=batch2/56; batch=2; NMR_run_ID=56 SUBJECT_SAMPLE_FACTORS 17 batch2_57 method:DMS | timepoint:8 | il2_conc:35 | carrier_conc:3000 | abs_surface_density:1282 RAW_FILE_NAME=batch2/57; batch=2; NMR_run_ID=57 SUBJECT_SAMPLE_FACTORS 15 batch2_58 method:DMS | timepoint:8 | il2_conc:30 | carrier_conc:500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/58; batch=2; NMR_run_ID=58 SUBJECT_SAMPLE_FACTORS 12 batch2_59 method:DMS | timepoint:14 | il2_conc:30 | carrier_conc:2500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/59; batch=2; NMR_run_ID=59 SUBJECT_SAMPLE_FACTORS 1 batch2_60 method:DMS | timepoint:11 | il2_conc:40 | carrier_conc:500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/60; batch=2; NMR_run_ID=60 SUBJECT_SAMPLE_FACTORS 4 batch2_61 method:DMS | timepoint:11 | il2_conc:30 | carrier_conc:2500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/61; batch=2; NMR_run_ID=61 SUBJECT_SAMPLE_FACTORS 16 batch2_62 method:DMS | timepoint:6 | il2_conc:35 | carrier_conc:1000 | abs_surface_density:1282 RAW_FILE_NAME=batch2/62; batch=2; NMR_run_ID=62 SUBJECT_SAMPLE_FACTORS 4 batch2_63 method:DMS | timepoint:4 | il2_conc:30 | carrier_conc:2500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/63; batch=2; NMR_run_ID=63 SUBJECT_SAMPLE_FACTORS 20 batch2_64 method:DMS | timepoint:6 | il2_conc:40 | carrier_conc:3500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/64; batch=2; NMR_run_ID=64 SUBJECT_SAMPLE_FACTORS 4 batch2_65 method:DMS | timepoint:6 | il2_conc:30 | carrier_conc:2500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/65; batch=2; NMR_run_ID=65 SUBJECT_SAMPLE_FACTORS 15 batch2_66 method:DMS | timepoint:14 | il2_conc:30 | carrier_conc:500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/66; batch=2; NMR_run_ID=66 SUBJECT_SAMPLE_FACTORS 2 batch2_67 method:DMS | timepoint:4 | il2_conc:35 | carrier_conc:2000 | abs_surface_density:1282 RAW_FILE_NAME=batch2/67; batch=2; NMR_run_ID=67 SUBJECT_SAMPLE_FACTORS 9 batch2_68 method:DMS | timepoint:8 | il2_conc:35 | carrier_conc:1000 | abs_surface_density:1729 RAW_FILE_NAME=batch2/68; batch=2; NMR_run_ID=68 SUBJECT_SAMPLE_FACTORS 1 batch2_69 method:DMS | timepoint:6 | il2_conc:40 | carrier_conc:500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/69; batch=2; NMR_run_ID=69 SUBJECT_SAMPLE_FACTORS 5 batch2_70 method:DMS | timepoint:6 | il2_conc:40 | carrier_conc:2500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/70; batch=2; NMR_run_ID=70 SUBJECT_SAMPLE_FACTORS 12 batch2_71 method:DMS | timepoint:11 | il2_conc:30 | carrier_conc:2500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/71; batch=2; NMR_run_ID=71 SUBJECT_SAMPLE_FACTORS 11 batch2_72 method:DMS | timepoint:11 | il2_conc:35 | carrier_conc:3000 | abs_surface_density:1729 RAW_FILE_NAME=batch2/72; batch=2; NMR_run_ID=72 SUBJECT_SAMPLE_FACTORS 18 batch2_73 method:DMS | timepoint:11 | il2_conc:40 | carrier_conc:3500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/73; batch=2; NMR_run_ID=73 SUBJECT_SAMPLE_FACTORS 8 batch2_74 method:DMS | timepoint:14 | il2_conc:35 | carrier_conc:2000 | abs_surface_density:1729 RAW_FILE_NAME=batch2/74; batch=2; NMR_run_ID=74 SUBJECT_SAMPLE_FACTORS 13 batch2_75 method:DMS | timepoint:8 | il2_conc:40 | carrier_conc:1500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/75; batch=2; NMR_run_ID=75 SUBJECT_SAMPLE_FACTORS 15 batch2_76 method:DMS | timepoint:6 | il2_conc:30 | carrier_conc:500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/76; batch=2; NMR_run_ID=76 SUBJECT_SAMPLE_FACTORS 13 batch2_77 method:DMS | timepoint:11 | il2_conc:40 | carrier_conc:1500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/77; batch=2; NMR_run_ID=77 SUBJECT_SAMPLE_FACTORS 14 batch2_78 method:DMS | timepoint:6 | il2_conc:40 | carrier_conc:500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/78; batch=2; NMR_run_ID=78 SUBJECT_SAMPLE_FACTORS 19 batch2_79 method:DMS | timepoint:4 | il2_conc:40 | carrier_conc:2500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/79; batch=2; NMR_run_ID=79 SUBJECT_SAMPLE_FACTORS 7 batch2_80 method:DMS | timepoint:6 | il2_conc:30 | carrier_conc:500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/80; batch=2; NMR_run_ID=80 SUBJECT_SAMPLE_FACTORS 19 batch2_81 method:DMS | timepoint:8 | il2_conc:40 | carrier_conc:2500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/81; batch=2; NMR_run_ID=81 SUBJECT_SAMPLE_FACTORS 3 batch2_82 method:DMS | timepoint:4 | il2_conc:30 | carrier_conc:1500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/82; batch=2; NMR_run_ID=82 SUBJECT_SAMPLE_FACTORS 6 batch2_83 method:DMS | timepoint:11 | il2_conc:40 | carrier_conc:1500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/83; batch=2; NMR_run_ID=83 SUBJECT_SAMPLE_FACTORS 3 batch2_84 method:DMS | timepoint:14 | il2_conc:30 | carrier_conc:1500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/84; batch=2; NMR_run_ID=84 SUBJECT_SAMPLE_FACTORS 11 batch2_85 method:DMS | timepoint:8 | il2_conc:35 | carrier_conc:3000 | abs_surface_density:1729 RAW_FILE_NAME=batch2/85; batch=2; NMR_run_ID=85 SUBJECT_SAMPLE_FACTORS 16 batch2_86 method:DMS | timepoint:4 | il2_conc:35 | carrier_conc:1000 | abs_surface_density:1282 RAW_FILE_NAME=batch2/86; batch=2; NMR_run_ID=86 SUBJECT_SAMPLE_FACTORS 16 batch2_87 method:DMS | timepoint:8 | il2_conc:35 | carrier_conc:1000 | abs_surface_density:1282 RAW_FILE_NAME=batch2/87; batch=2; NMR_run_ID=87 SUBJECT_SAMPLE_FACTORS 1 batch2_88 method:DMS | timepoint:4 | il2_conc:40 | carrier_conc:500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/88; batch=2; NMR_run_ID=88 SUBJECT_SAMPLE_FACTORS 18 batch2_89 method:DMS | timepoint:4 | il2_conc:40 | carrier_conc:3500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/89; batch=2; NMR_run_ID=89 SUBJECT_SAMPLE_FACTORS n/a batch2_90 method:Internal_control | timepoint:n/a | il2_conc:n/a | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch2/90; batch=2; NMR_run_ID=90 SUBJECT_SAMPLE_FACTORS 8 batch2_91 method:DMS | timepoint:11 | il2_conc:35 | carrier_conc:2000 | abs_surface_density:1729 RAW_FILE_NAME=batch2/91; batch=2; NMR_run_ID=91 SUBJECT_SAMPLE_FACTORS 5 batch2_92 method:DMS | timepoint:14 | il2_conc:40 | carrier_conc:2500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/92; batch=2; NMR_run_ID=92 SUBJECT_SAMPLE_FACTORS 9 batch2_93 method:DMS | timepoint:6 | il2_conc:35 | carrier_conc:1000 | abs_surface_density:1729 RAW_FILE_NAME=batch2/93; batch=2; NMR_run_ID=93 SUBJECT_SAMPLE_FACTORS 3 batch2_94 method:DMS | timepoint:6 | il2_conc:30 | carrier_conc:1500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/94; batch=2; NMR_run_ID=94 SUBJECT_SAMPLE_FACTORS 13 batch2_95 method:DMS | timepoint:14 | il2_conc:40 | carrier_conc:1500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/95; batch=2; NMR_run_ID=95 SUBJECT_SAMPLE_FACTORS n/a batch2_96 method:Buffer_control | timepoint:n/a | il2_conc:n/a | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch2/96; batch=2; NMR_run_ID=96 SUBJECT_SAMPLE_FACTORS 7 batch2_97 method:DMS | timepoint:14 | il2_conc:30 | carrier_conc:500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/97; batch=2; NMR_run_ID=97 SUBJECT_SAMPLE_FACTORS 20 batch2_98 method:DMS | timepoint:11 | il2_conc:40 | carrier_conc:3500 | abs_surface_density:1729 RAW_FILE_NAME=batch2/98; batch=2; NMR_run_ID=98 SUBJECT_SAMPLE_FACTORS 17 batch2_99 method:DMS | timepoint:14 | il2_conc:35 | carrier_conc:3000 | abs_surface_density:1282 RAW_FILE_NAME=batch2/99; batch=2; NMR_run_ID=99 SUBJECT_SAMPLE_FACTORS n/a batch2_100 method:Internal_control | timepoint:n/a | il2_conc:n/a | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch2/100; batch=2; NMR_run_ID=100 SUBJECT_SAMPLE_FACTORS 12 batch2_101 method:DMS | timepoint:4 | il2_conc:30 | carrier_conc:2500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/101; batch=2; NMR_run_ID=101 SUBJECT_SAMPLE_FACTORS 2 batch2_102 method:DMS | timepoint:8 | il2_conc:35 | carrier_conc:2000 | abs_surface_density:1282 RAW_FILE_NAME=batch2/102; batch=2; NMR_run_ID=102 SUBJECT_SAMPLE_FACTORS 15 batch2_103 method:DMS | timepoint:11 | il2_conc:30 | carrier_conc:500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/103; batch=2; NMR_run_ID=103 SUBJECT_SAMPLE_FACTORS 14 batch2_104 method:DMS | timepoint:4 | il2_conc:40 | carrier_conc:500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/104; batch=2; NMR_run_ID=104 SUBJECT_SAMPLE_FACTORS 10 batch2_105 method:DMS | timepoint:6 | il2_conc:30 | carrier_conc:1500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/105; batch=2; NMR_run_ID=105 SUBJECT_SAMPLE_FACTORS 5 batch2_106 method:DMS | timepoint:4 | il2_conc:40 | carrier_conc:2500 | abs_surface_density:1282 RAW_FILE_NAME=batch2/106; batch=2; NMR_run_ID=106 SUBJECT_SAMPLE_FACTORS 9 batch2_107 method:DMS | timepoint:4 | il2_conc:35 | carrier_conc:1000 | abs_surface_density:1729 RAW_FILE_NAME=batch2/107; batch=2; NMR_run_ID=107 SUBJECT_SAMPLE_FACTORS n/a batch2_108 method:Buffer_control_last | timepoint:n/a | il2_conc:n/a | carrier_conc:n/a | abs_surface_density:n/a RAW_FILE_NAME=batch2/108; batch=2; NMR_run_ID=108 #COLLECTION CO:COLLECTION_SUMMARY Conditioned culture media (Miltenyi Texmacs media). Was collected via pipetting CO:COLLECTION_SUMMARY as described in sample prep protocol document. CO:SAMPLE_TYPE T-cells CO:COLLECTION_METHOD Pipette CO:VOLUMEORAMOUNT_COLLECTED 60 uL CO:STORAGE_CONDITIONS -80℃ #TREATMENT TR:TREATMENT_SUMMARY Cultures were prepared with varied IL2 concentration, DMS concentration, and DMS TR:TREATMENT_SUMMARY surface densities as described in study design. Culture media was replenished on TR:TREATMENT_SUMMARY days 4, 6, 8, 11 after sampling. TR:CELL_MEDIA Miltenyi Texmacs (Cat. 170-076-307) #SAMPLEPREP SP:SAMPLEPREP_SUMMARY Media samples were thawed at 4°C, then centrifuged at maximum speed for 15 SP:SAMPLEPREP_SUMMARY minutes. 45 uL were transferred directly to NMR tube containing 5 uL of D2O with SP:SAMPLEPREP_SUMMARY 100 uM DSS and mixed. Remaining supernatant from each sample combined for SP:SAMPLEPREP_SUMMARY internal controls. SP:SAMPLEPREP_PROTOCOL_FILENAME mbcolonna_20200812_100701_PR_SP_protocol.pdf SP:PROCESSING_STORAGE_CONDITIONS 4℃ SP:EXTRACTION_METHOD None #ANALYSIS AN:ANALYSIS_TYPE NMR AN:LABORATORY_NAME Edison AN:OPERATOR_NAME Maxwell Colonna AN:DATA_FORMAT Bruker #NMR NM:INSTRUMENT_NAME Bruker Avance III HD NM:INSTRUMENT_TYPE FT-NMR NM:NMR_EXPERIMENT_TYPE 1D-1H NM:FIELD_FREQUENCY_LOCK Deuterium NM:SPECTROMETER_FREQUENCY 600 MHz NM:NMR_PROBE 5mm TCI NM:NMR_SOLVENT 90% H2O, 10% D2O NM:NMR_TUBE_SIZE 1.7mm NM:SHIMMING_METHOD Topshim NM:PULSE_SEQUENCE noesypr1d NM:WATER_SUPPRESSION Presaturation NM:PULSE_WIDTH 7.45 us NM:POWER_LEVEL 5.5584 W NM:RECEIVER_GAIN 203 NM:OFFSET_FREQUENCY 2819.9 Hz NM:PRESATURATION_POWER_LEVEL 1.2333e-05 W NM:CHEMICAL_SHIFT_REF_CPD DSS NM:TEMPERATURE 25 NM:NUMBER_OF_SCANS 128 NM:DUMMY_SCANS 4 NM:ACQUISITION_TIME 2.72 s NM:RELAXATION_DELAY 4 s NM:SPECTRAL_WIDTH 20 ppm NM:NUM_DATA_POINTS_ACQUIRED 65382 NM:LINE_BROADENING 0.3 Hz NM:BASELINE_CORRECTION_METHOD Polynomial order 5 NM:NMR_RESULTS_FILE ST001476_AN002452_Results.txt UNITS:AU #END