BioLiP

PDB

BioLiP

PDB CCD ID:

ZO3

Number of entries in BioLiP:

Chemical formula:

H6 O3 Zn

InChI:

InChI=1/3H2O.Zn/h3*1H2;/q;;;+2/rH6O3Zn/c1-4(2)3/h1-3H2/q+2

InChIKey:

FTXMHASAYZWVCS-MAMYJRRWAA

SMILES:

Software	SMILES
OpenEye OEToolkits 1.5.0	[OH2][Zn+2]([OH2])[OH2]
CACTVS 3.341	O\|[Zn++](\|O)\|O

Name:

ZINC 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).