BioLiP

PDB

BioLiP

PDB CCD ID:

UOX

Number of entries in BioLiP:

Chemical formula:

C3 H6 N O3 Se

InChI:

InChI=1S/C3H6NO3Se/c4-2(1-8-7)3(5)6/h2H,1,4H2,(H,5,6)/q-1/t2-/m0/s1

InChIKey:

IYJUXUMKLGMZHJ-REOHCLBHSA-N

SMILES:

Software	SMILES
ACDLabs 12.01	O=C(O)C(N)C[SeH]=O
OpenEye OEToolkits 2.0.7	C(C(C(=O)O)N)[Se-]=O
OpenEye OEToolkits 2.0.7	C([C@@H](C(=O)O)N)[Se-]=O
CACTVS 3.385	N[C@@H](C[Se-]=O)C(O)=O
CACTVS 3.385	N[CH](C[Se-]=O)C(O)=O

Name:

3-(oxido-lambda~4~-selanyl)-L-alanine

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).