Non-natural sidechain SwissSidechain - PPN
3D view
| Name | 4-Nitro-phenylalanine |
| Molecular Weight [g/mol] | 210.19 |
| logP | -1.25 |
| Sidechain logP | 2.37 |
| Volume [Å3 ] | 223.74 |
| Sidechain Volume [Å3 ] | 138.07 |
| pKa | 1.16 / 9.37 (predicted) |
| SMILES | O=[C](=O)[C@H](Cc1ccc(cc1)N(=O)=O)[NH3] |
| D-amino acid code | DPPN |
| PDB References: | |
| L-amino acid | PDB | Ligand |
| D-amino acid | Not available |
| PubChem | L: 13706 | D: 679497 |
| CAS number | L: 949-99-5 | D: 56613-61-7 |
Download:
| Files | L-amino acid | D-amino acid | |
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| PDB |
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| MOL2 | |
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| 2D structures (PNG) | |
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| backbone-dependent rotamers | |
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| backbone-independent rotamers | |
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| Gromacs topology file | |
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| CHARMM topology file | |
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