Non-natural sidechain SwissSidechain - THIC
3D view
| Name | Thio-citrulline |
| Molecular Weight [g/mol] | 192.26 |
| logP | -0.68 (predicted) |
| Sidechain logP | 0.46 (predicted) |
| Volume [Å3 ] | 212.10 |
| Sidechain Volume [Å3 ] | 126.44 |
| pKa | 2.69 / 9.23 (predicted) |
| SMILES | OC(=O)[C@H](CCC[NH]=[C](=S)=[NH2])[NH3] |
| D-amino acid code | DTVI |
| PDB References: | |
| L-amino acid | Not available |
| D-amino acid | Not available |
| PubChem | |
| CAS number |
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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