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Non-natural sidechain SwissSidechain - THR

3D view

Name Threonine
Molecular Weight [g/mol] 120.13
logP -2.98
Sidechain logP -0.3
Volume [Å3 ] 137.26
Sidechain Volume [Å3 ] 51.59
pKa 2.09 / 9.1
SMILES [NH3][C@@H]([C@@H](C)O)C(=O)O
D-amino acid code DTH ;(PDB: DTH)
PDB References:
L-amino acid PDB   |   Ligand
D-amino acid PDB   |   Ligand
PubChem L:  6288  |  D:  69435
CAS number L: 72-19-5  |  D: 632-20-2


Files L-amino acid D-amino acid
2D structures (PNG)
backbone-dependent rotamers
backbone-independent rotamers
Gromacs topology file Gromacs
CHARMM topology file CHARMM