BioLiP

PDB

BioLiP

PDB CCD ID:

6M0

Number of entries in BioLiP:

Chemical formula:

H16 Mo6 O26

InChI:

InChI=1S/6Mo.2O2.16H2O.6O/c;;;;;;2*1-2;;;;;;;;;;;;;;;;;;;;;;/h;;;;;;;;16*1H2;;;;;;/q+1;2*+3;2*+4;+5;2*-2;;;;;;;;;;;;;;;;;;;;;;/p-16

InChIKey:

DEGKPRAGDPFTOO-UHFFFAOYSA-A

SMILES:

Software	SMILES
CACTVS 3.385	O[Mo]1O[Mo](O)(O)(O)(O[Mo](O)(O)(O)O)O[Mo](O)(O)(O)(O1)O[Mo]2(O)(O)(OO2)O[Mo]3(O)(O)(O)OO3
OpenEye OEToolkits 1.7.6	O[Mo]1O[Mo](O[Mo](O1)(O)(O)(O)O[Mo]2(OO2)(O)(O)O[Mo]3(OO3)(O)(O)O)(O)(O)(O)O[Mo](O)(O)(O)O

Name:

MO(6)-O(26) 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).