BioLiP

PDB

BioLiP

PDB CCD ID:

YWF

Number of entries in BioLiP:

Chemical formula:

C4 H7 N O2

InChI:

InChI=1S/C4H7NO2/c5-3-1-2-4(6)7/h1-2H,3,5H2,(H,6,7)/b2-1+

InChIKey:

FMKJUUQOYOHLTF-OWOJBTEDSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	C(C=CC(=O)O)N
CACTVS 3.385	NCC=CC(O)=O
OpenEye OEToolkits 2.0.7	C(/C=C/C(=O)O)N
CACTVS 3.385	NC\C=C\C(O)=O

Name:

gamma-aminobutenoic acid;
(E)-4-azanylbut-2-enoic 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).