BioLiP

PDB

BioLiP

PDB CCD ID:

1KH

Number of entries in BioLiP:

Chemical formula:

C5 H13 As O8

InChI:

InChI=1S/C5H13AsO8/c7-2(1-6(12,13)14)3(8)4(9)5(10)11/h2-5,7-11H,1H2,(H2,12,13,14)/t2-,3+,4-/m1/s1

InChIKey:

MSQKZAOQSOMILW-FLRLBIABSA-N

SMILES:

Software	SMILES
CACTVS 3.370	OC(O)[CH](O)[CH](O)[CH](O)C[As](O)(O)=O
OpenEye OEToolkits 1.7.6	C(C(C(C(C(O)O)O)O)O)[As](=O)(O)O
CACTVS 3.370	OC(O)[C@H](O)[C@@H](O)[C@H](O)C[As](O)(O)=O
OpenEye OEToolkits 1.7.6	C([C@H]([C@@H]([C@H](C(O)O)O)O)O)[As](=O)(O)O

Name:

arsenoribose

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).