Underlying Data for S1PR1 Agonist Selectivity Analysis

Leiye Yu published this dataset on figshare in April 2026. It contains the underlying data for figures 5E–5G in a study on sphingosine-1-phosphate receptor subtype selectivity. The 17.6 KB XLSX file likely includes structural and pharmacological assay results from an integrated approach combining cryo-EM, molecular dynamics, and pharmacology.

Use Cases

• Analyzing molecular determinants of agonist selectivity based on structural features mentioned in the description
• Training models to predict ligand-receptor interactions based on binding pocket residue data
• Comparing agonist binding orientations across S1PR subtypes based on reported structural analysis
• Validating molecular dynamics simulations of receptor-ligand complexes using the provided assay data

Strengths

• Data is directly linked to published structural findings from cryo-electron microscopy
• Dataset is openly licensed under CC-BY-4.0
• File is a small (17.6 KB) and likely portable XLSX format

Limitations

• Row count and column-level documentation are absent; field semantics must be inferred after download
• Description metadata is limited; actual data quality requires manual inspection after download

Provenance

Source

Leiye Yu via figshare

Collection Method

Integrated approach combining cryo-electron microscopy structures, molecular dynamics simulations, and pharmacological assays

Time Range

Publication date suggests data is from 2026 or earlier

Freshness

Last updated 2026-04-10 17:44:58; freshness should be verified

Geography

Spatial coverage is not specified