BioLiP

PDB

BioLiP

PDB CCD ID:

PRW

Number of entries in BioLiP:

Chemical formula:

C4 H9 N O4

InChI:

InChI=1S/C4H9NO4/c5-1-2(6)3(7)4(8)9/h2-3,6-7H,1,5H2,(H,8,9)/t2-,3-/m1/s1

InChIKey:

WITVYMTUWTVRND-PWNYCUMCSA-N

SMILES:

Software	SMILES
ACDLabs 10.04	O=C(O)C(O)C(O)CN
OpenEye OEToolkits 1.6.1	C([C@H]([C@H](C(=O)O)O)O)N
CACTVS 3.352	NC[CH](O)[CH](O)C(O)=O
OpenEye OEToolkits 1.6.1	C(C(C(C(=O)O)O)O)N
CACTVS 3.352	NC[C@@H](O)[C@@H](O)C(O)=O

Name:

(2R,3R)-4-AMINO-2,3-DIHYDROXYBUTANOIC ACID

Reference:

Chengxin Zhang, Xi Zhang, Lydia Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023).

Jianyi Yang, Ambrish Roy, and Yang Zhang. BioLiP: a semi-manually curated database for biologically relevant ligand-protein interactions, Nucleic Acids Research, 41: D1096-D1103 (2013) (download the PDF file).