BioLiP

PDB

BioLiP

PDB CCD ID:

ODV

Number of entries in BioLiP:

Chemical formula:

C2 H8 N O4 P

InChI:

InChI=1S/C2H8NO4P/c3-1-2(4)8(5,6)7/h2,4H,1,3H2,(H2,5,6,7)/t2-/m1/s1

InChIKey:

RTTXIBKRJFIBBG-UWTATZPHSA-N

SMILES:

Software	SMILES
CACTVS 3.385	NC[CH](O)[P](O)(O)=O
CACTVS 3.385	NC[C@H](O)[P](O)(O)=O
ACDLabs 12.01	O=P(O)(O)C(O)CN
OpenEye OEToolkits 1.7.6	C([C@H](O)P(=O)(O)O)N
OpenEye OEToolkits 1.7.6	C(C(O)P(=O)(O)O)N

Name:

[(1R)-2-amino-1-hydroxyethyl]phosphonic acid

ZINC:

ZINC000019204143

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).