BioLiP

PDB

BioLiP

PDB CCD ID:

CUN

Number of entries in BioLiP:

Chemical formula:

Cu H Mo O2 S

InChI:

InChI=1S/Cu.Mo.H2O.O.S/h;;1H2;;/q+1;+5;;;/p-1

InChIKey:

GIYZUGIRDQLYSY-UHFFFAOYSA-M

SMILES:

Software	SMILES
CACTVS 3.370 OpenEye OEToolkits 1.7.2	O[Mo+4](=O)S[Cu+]
ACDLabs 12.01	[Cu+]S[Mo+4](=O)O

Name:

CU(I)-S-MO(IV)(=O)OH CLUSTER

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).