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Non-natural sidechain SwissSidechain - ASP

3D view

Name Aspartate
Molecular Weight [g/mol] 134.11
logP -3.68
Sidechain logP -0.17
Volume [Å3 ] 137.99
Sidechain Volume [Å3 ] 52.33
pKa 2.1 / 9.82 / 3.9
SMILES [NH3][C@@H](CC(=O)O)C(=O)O
D-amino acid code DAS ;(PDB: DAS)
PDB References:
L-amino acid PDB   |   Ligand
D-amino acid PDB   |   Ligand
PubChem L:  5960  |  D:  83887
CAS number L: 56-84-8  |  D: 1783-96-6

Download:

Files L-amino acid D-amino acid
PDB
MOL2
2D structures (PNG)
backbone-dependent rotamers
backbone-independent rotamers
Gromacs topology file Gromacs
CHARMM topology file CHARMM
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