Non-natural sidechain SwissSidechain - BUG
3D view
| Name | Tertleucine |
| Molecular Weight [g/mol] | 132.18 |
| logP | -1.77 |
| Sidechain logP | 2.76 |
| Volume [Å3 ] | 166.25 |
| Sidechain Volume [Å3 ] | 80.58 |
| pKa | 2.79 / 9.32 (predicted) |
| SMILES | [NH3][C@@H](C(C)(C)C)C(=O)O |
| D-amino acid code | DBUG |
| PDB References: | |
| L-amino acid | PDB | Ligand |
| D-amino acid | Not available |
| PubChem | L: 164608 | D: 6950340 |
| CAS number | L: 20859-02-3 | D: 26782-71-8 |
Download:
| Files | L-amino acid | D-amino acid | |
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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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