PPIRE18786
Target Protein Information
| Protein_Name | Protein S100-A1 |
|---|---|
| Protein_Sequence | MGSELETAMETLINVFHAHSGKEGDKYKLSKKELKDLLQTELSSFLDVQKDADAVDKIMKELDENGDGEVDFQEFVVLVAALTVACNNFFWENS |
| Organism_Source | Rattus norvegicus |
| Functional_Classification | EF hand Ca2+ binding proteins |
| Cellular_Localization | Cytoplasm |
| Gene_Names | S100a1 |
| UniProt_ID | P35467 |
| Protein-Protein Interaction Networks | |
Peptide Basic Information
| Peptide_Name | TAMRA-K12 |
|---|---|
| Peptide_Sequence | TRTKIDWNKILS |
| Peptide_Length | 12 |
| Peptide_SMILES | CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O |
| Chemical_Modification | None |
| Cyclization_Method | None |
| Linear/Cyclic | Linear |
| N-terminal_Modification | TAMRA |
| C-terminal_Modification | Amide |
| Amino_Acid_Distribution | |
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Peptide Physicochemical
| Molecular_Weight | 1474.72 |
|---|---|
| Aliphatic_Index | 97.50000 |
| Aromaticity | 0.08333 |
| Average_Rotatable_Bonds | 4.16667 |
| Charge_at_pH_7 | 1.99784 |
| Isoelectric_Point | 10.78901 |
|---|---|
| Hydrogen_Bond_Acceptors | 21 |
| Hydrogen_Bond_Donors | 24 |
| Topological_Polar_Surface_Area | 654.23000 |
| X_logP_energy | -5.78133 |
Interaction Information
| Affinity | KD=1 uM |
|---|---|
| Affinity_Assay | Fluorescence Polarization |
| PDB_ID | 2KBM |
| Type | Affinity ligand |
| Structure | |
Reference Information
| Document_Type | Research Articles |
|---|---|
| Title | Solution Structure of S100A1 Bound to the CapZ Peptide (TRTK12) |
| Release_Year | 2009 |
| PMID | 19452629 |
| DOI | 10.1016/j.jmb.2009.01.022 |