BioLiP

PDB

BioLiP

PDB CCD ID:

GLJ

Number of entries in BioLiP:

Chemical formula:

C5 H11 N O4

InChI:

InChI=1S/C5H11NO4/c6-3(5(9)10)1-2-4(7)8/h3-4,7-8H,1-2,6H2,(H,9,10)/t3-/m0/s1

InChIKey:

FIKXYBCGRJPSSD-VKHMYHEASA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 1.7.0	C(CC(O)O)C(C(=O)O)N
OpenEye OEToolkits 1.7.0	C(CC(O)O)[C@@H](C(=O)O)N
CACTVS 3.370	N[C@@H](CCC(O)O)C(O)=O
ACDLabs 12.01	O=C(O)C(N)CCC(O)O
CACTVS 3.370	N[CH](CCC(O)O)C(O)=O

Name:

5,5-dihydroxy-L-norvaline

ZINC:

ZINC000098208955

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).