Non-natural sidechain SwissSidechain - TYI
3D view
| Name | 3,5-diiodotyrosine |
| Molecular Weight [g/mol] | 433.99 |
| logP | -0.46 (predicted) |
| Sidechain logP | 4.2 |
| Volume [Å3 ] | 252.64 |
| Sidechain Volume [Å3 ] | 166.98 |
| pKa | 1.47 / 9.45 / 7.23 (predicted) |
| SMILES | OC(=O)[C@H](Cc1cc(I)c(c(c1)I)O)[NH3] |
| D-amino acid code | DTYI |
| PDB References: | |
| L-amino acid | PDB | Ligand |
| D-amino acid | Not available |
| PubChem | |
| CAS number | L: 300-39-0 | D: 16711-71-0 |
Download:
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| MOL2 | |
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| 2D structures (PNG) | |
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| Gromacs topology file | |
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| CHARMM topology file | |
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