BioLiP

PDB

BioLiP

PDB CCD ID:

SOW

Number of entries in BioLiP:

Chemical formula:

C4 H8 N2 O3

InChI:

InChI=1S/C4H8N2O3/c5-3(7)1-6-2-4(8)9/h6H,1-2H2,(H2,5,7)(H,8,9)

InChIKey:

AWEZYTUWDZADKR-UHFFFAOYSA-N

SMILES:

Software	SMILES
ACDLabs 12.01	NC(=O)CNCC(=O)O
OpenEye OEToolkits 2.0.7	C(C(=O)N)NCC(=O)O
CACTVS 3.385	NC(=O)CNCC(O)=O

Name:

[(2-amino-2-oxoethyl)amino]acetic 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).