BioLiP

PDB

BioLiP

PDB CCD ID:

NAW

Number of entries in BioLiP:

Chemical formula:

H6 Na O3

InChI:

InChI=1/Na.3H2O/h;3*1H2/q-2;;;/rH6NaO3/c2-1(3)4/h2-4H2/q-2

InChIKey:

VZLNGZPHSOIKER-BJIWCTOXAB

SMILES:

Software	SMILES
CACTVS 3.341 OpenEye OEToolkits 1.5.0	[OH2-][Na+]([OH2-])[OH2-]

Name:

SODIUM ION, 3 WATERS COORDINATED

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).