BioLiP

PDB

BioLiP

PDB CCD ID:

IPS

Number of entries in BioLiP:

Chemical formula:

H O4 P

InChI:

InChI=1/H3O4P/c1-5(2,3)4/h(H3,1,2,3,4)/p-2/fHO4P/h1H/q-2

InChIKey:

NBIIXXVUZAFLBC-CCWBEWRDCN

SMILES:

Software	SMILES
ACDLabs 10.04	[O-]P([O-])(=O)O
OpenEye OEToolkits 1.5.0	OP(=O)([O-])[O-]
CACTVS 3.341	O[P]([O-])([O-])=O

Name:

INORGANIC PHOSPHATE GROUP

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).