2AS

(2S,3S)-3-methyl-aspartic acid

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is present as a standalone ligand in 3 entries

as a non-polymer is covalently linked to polymer or other heterogen groups 1 entries

is present in a polymer sequence 1 entries

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Chemical Component Summary
Name	(2S,3S)-3-methyl-aspartic acid
Identifiers	(2S,3S)-2-azanyl-1,4-dihydroxy-3-methyl-butane-1,1-dione
Formula	C₅ H₉ N O₄
Molecular Weight	147.129
Type	L-PEPTIDE LINKING
Isomeric SMILES	C[C@H]([C]O)[C@@H](C(=O)(=O)O)N
InChI	InChI=1S/C5H9NO4/c1-2(4(7)8)3(6)5(9)10/h2-3H,6H2,1H3,(H,7,8)(H,9,10)/t2-,3-/m0/s1
InChIKey	LXRUAYBIUSUULX-HRFVKAFMSA-N

Chemical Details
Formal Charge	0
Atom Count	19
Chiral Atom Count	2
Bond Count	18
Aromatic Bond Count	0

Drug Info: DrugBank

DrugBank ID	DB04538
Name	threo-3-methyl-L-aspartic acid
Groups	experimental
Synonyms	L-threo-3-Methylaspartate (3S)-3-methyl-L-aspartic acid threo-3-methyl-L-aspartic acid 2S,3S-3-methylaspartic acid
CAS number	6061-13-8

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
3-methylaspartate ammonia-lyase	MKIKQALFTAGYSSFYFDDQQAIKNGAGHDGFIYTGDPVTPGFTSVRQAG...	unknown

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682