BioLiP

PDB

BioLiP

PDB CCD ID:

FV2

Number of entries in BioLiP:

Chemical formula:

Mo8 O30

InChI:

InChI=1S/8Mo.18H2O.12O/h;;;;;;;;18*1H2;;;;;;;;;;;;/q2*+1;2*+2;4*+3;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/p-18

InChIKey:

OYDJOMQLWBZCKT-UHFFFAOYSA-A

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.6	[O][Mo]12(O[Mo]3(O[Mo]456(O3[Mo]7(O1)(O2[Mo]8(O7[Mo]91(O4)(O8[Mo]2(O9[Mo](O15)(O2)(O6)([O])[O])([O])([O])[O])[O])([O])([O])[O])([O])[O])[O])([O])([O])[O])([O])[O]
CACTVS 3.385	O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O1[Mo]O[Mo]23O[Mo]O[Mo]45O[Mo](O[Mo](O[Mo]1O2)O3)O[Mo](O4)O5

Name:

Mo8 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).