Sequence Alignment to Predict Across Species Susceptibility (SeqAPASS)

About


The SeqAPASS Tool was developed by Dr. Carlie LaLone and the Environmental Modeling and Visualization Laboratory for:

U.S. Environmental Protection Agency,
Center for Computational Toxicology and Exposure
Great Lakes Toxicology and Ecology Division,
Duluth, MN


Contact: SeqAPASS.support@epa.gov

Software Information
Java VersionPrimeFaces VersionTomcat VersionDatabase Version
Java 8 Enterprise Edition (http://www.oracle.com/technetwork/java/javaee)Java PrimeFaces 11.0 (http://primefaces.org)Apache Tomcat 8.5 (https://tomcat.apache.org/)MariaDB 10.3.39

NCBI Information (See References)
Data VersionInstallation DateSeqAPASS VersionBLAST+ VersionProtein and Taxonomy DatabaseCDD DatabaseCobalt DatabaseCobalt VersionI-TASSER VersionTM-align VersionUniProt Database
801/26/2024 03:00 PM7.12.15.001/11/202309/21/202208/03/20230.755.22021022401/19/2024
709/05/2023 04:00 PM7.02.13.004/25/202202/23/202107/09/20100.755.22021022408/01/2023
706/07/2022 01:00 PM6.12.13.004/25/202202/23/202107/09/20100.75--
609/14/2021 01:00 PM6.02.11.004/28/202102/23/202107/09/20100.75--
607/15/2021 04:00 PM5.12.11.004/28/202102/23/202107/09/20100.75--
512/01/2020 04:30 PM5.02.10.006/08/202004/30/202007/09/20100.75--
508/25/2020 12:00 PM4.12.10.006/08/202004/30/202007/09/20100.75--
410/24/2019 10:30 AM4.02.8.102/28/201912/08/201607/09/20100.75--
405/15/2019 10:45 AM3.22.8.102/28/201912/08/201607/09/20100.75--
303/04/2019 05:54 PM3.12.6.010/25/201712/08/201607/09/20100.75--
303/10/2018 02:12 AM3.02.6.010/25/201712/08/201607/09/20100.75--
205/24/2017 06:59 PM2.02.5.001/04/201702/05/201607/09/20100.75--
101/27/2016 08:00 PM1.02.3.011/09/201604/25/201507/09/20100.75--


Threatened/Endangered Species Data obtained from EPA ECOTOX on Dec. 14, 2023



References:

NCBI Protein Database
Pruitt, K. D., Tatusova, T., Maglott, D. R. (2007). NCBI reference sequences (RefSeq): a curated non-redundant sequence database of genomes, transcripts and proteins. Nucleic acids research, 35(suppl_1), D61-D65. https://doi.org/10.1093/nar/gkl842

NCBI Taxonomy Database
Federhen, S. (2012). The NCBI taxonomy database. Nucleic acids research, 40(D1), D136-D143. https://doi.org/10.1093/nar/gkr1178

NCBI BLAST
Altschul, S. F., Gish, W., Miller, W., Myers, E. W., Lipman, D. J. (1990). Basic local alignment search tool. Journal of molecular biology, 215(3), 403-410. https://doi.org/10.1016/S0022-2836(05)80360-2

NCBI Conserved Domain Database
Marchler-Bauer, A., Zheng, C., Chitsaz, F., Derbyshire, M. K., Geer, L. Y., Geer, R. C., ... & Bryant, S. H. (2012). CDD: conserved domains and protein three-dimensional structure. Nucleic acids research, 41(D1), D348-D352. https://doi.org/10.1093/nar/gks1243

NCBI COBALT
Papadopoulos, J. S., Agarwala, R. (2007). COBALT: constraint-based alignment tool for multiple protein sequences. Bioinformatics, 23(9), 1073-1079. https://doi.org/10.1093/bioinformatics/btm076

ECOS Environmental Conservation Online System
US Fish and Wildlife Service. (2018). ECOS Environmental Conservation Online System. Website https://ecos.fws.gov/ecp/[accessed 26 June 2023].

ECOTOX Knowledgebase
Olker, J.H., Elonen, C.M., Pilli, A., Anderson, A., Kinziger, B., Erickson, S., Skopinski, M., Pomplun, A., LaLone, C.A., Russom, C.L., Hoff, D. (2022). The ECOTOXicology knowledgebase: A curated database of ecologically relevant toxicity tests to support environmental research and risk assessment. Environmental Toxicology and Chemistry, 41(6), 1520-1539. https://doi.org/10.1002/etc.5324

CompTox Chemicals Dashboard
Williams, A.J., Grulke, C.M., Edwards, J., McEachran, A.D., Mansouri, K., Baker, N.C., Patlewicz, G., Shah, I., Wambaugh, J.F., Judson, R.S., Richard, A.M. (2017). The CompTox Chemistry Dashboard: a community data resource for environmental chemistry. Journal of cheminformatics, 9, 1-27. https://doi.org/10.1186/s13321-017-0247-6

RCSB PDB
Rose, P.W., Prlić, A., Altunkaya, A., Bi, C., Bradley, A.R., Christie, C.H., Costanzo, L.D., Duarte, J.M., Dutta, S., Feng, Z., Green, R.K. (2016). The RCSB protein data bank: integrative view of protein, gene and 3D structural information. Nucleic acids research, gkw1000. https://doi.org/10.1093/nar/gkw1000

I-TASSER
Yang, J., Zhang, Y. (2015). I-TASSER server: new development for protein structure and function predictions. Nucleic acids research, 43(W1), W174-W181. https://doi.org/10.1093/nar/gkv342

AlphaFold
Varadi, M., Anyango, S., Deshpande, M., Nair, S., Natassia, C., Yordanova, G., Yuan, D., Stroe, O., Wood, G., Laydon, A. and Žídek, A. (2022). AlphaFold Protein Structure Database: massively expanding the structural coverage of protein-sequence space with high-accuracy models. Nucleic acids research, 50(D1), D439-D444. https://doi.org/10.1093/nar/gkab1061

TM-align
Zhang, Y., Skolnick, J. (2005). TM-align: a protein structure alignment algorithm based on the TM-score. Nucleic acids research, 33(7), 2302-2309. https://doi.org/10.1093/nar/gki524


SeqAPASS Help:
For SeqAPASS user guide and data visualization workspace, click here.