BioLiP

PDB

BioLiP

PDB CCD ID:

MYQ

Number of entries in BioLiP:

Chemical formula:

C4 H5 Au O4 S

InChI:

InChI=1S/C4H6O4S.Au/c5-3(6)1-2(9)4(7)8;/h2,9H,1H2,(H,5,6)(H,7,8);/q;+1/p-1/t2-;/m0./s1

InChIKey:

XJHSMFDIQHVMCY-DKWTVANSSA-M

SMILES:

Software	SMILES
ACDLabs 10.04	O=C(O)CC(S[Au])C(=O)O
OpenEye OEToolkits 1.5.0	C([C@@H](C(=O)O)S[Au])C(=O)O
CACTVS 3.341	OC(=O)C[CH](S[Au])C(O)=O
OpenEye OEToolkits 1.5.0	C(C(C(=O)O)S[Au])C(=O)O
CACTVS 3.341	OC(=O)C[C@H](S[Au])C(O)=O

Name:

(S)-(1,2-DICARBOXYETHYLTHIO)GOLD;
MYOCRISIN

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).