BioLiP

PDB

BioLiP

PDB CCD ID:

MYO

Number of entries in BioLiP:

Chemical formula:

C5 H5 N3 O4

InChI:

InChI=1S/C5H5N3O4/c6-1-2(4(9)10)7-8-3(1)5(11)12/h6H2,(H,7,8)(H,9,10)(H,11,12)

InChIKey:

IGUCGPRNZVGVNO-UHFFFAOYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	c1(c([nH]nc1C(=O)O)C(=O)O)N
CACTVS 3.385	Nc1c([nH]nc1C(O)=O)C(O)=O

Name:

4-azanyl-1~{H}-pyrazole-3,5-dicarboxylic 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).