Non-natural sidechain SwissSidechain - TPO
3D view
| Name | phosphothreonine |
| Molecular Weight [g/mol] | 200.11 |
| logP | -3.75 (predicted) |
| Sidechain logP | -1.19 (predicted) |
| Volume [Å3 ] | 187.00 |
| Sidechain Volume [Å3 ] | 101.33 |
| pKa | 2.27 / 8.72 / 6.7 / 1.72 (predicted) |
| SMILES | C[C@H]([C@@H]([C](=O)=O)[NH3])OP(O)(O)O |
| D-amino acid code | DTPO ;(PDB: D11) |
| PDB References: | |
| L-amino acid | PDB | Ligand |
| D-amino acid | PDB | Ligand |
| PubChem | |
| CAS number | L: 1114-81-4 | D: 96193-69-0 |
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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