BioLiP

PDB

BioLiP

PDB CCD ID:

GHG

Number of entries in BioLiP:

Chemical formula:

C5 H10 N2 O4

InChI:

InChI=1S/C5H10N2O4/c6-2(5(10)11)1-3(8)4(7)9/h2-3,8H,1,6H2,(H2,7,9)(H,10,11)/t2-,3-/m0/s1

InChIKey:

VTJRNXQBJNWLRA-HRFVKAFMSA-N

SMILES:

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

Name:

(2S,4S)-2,5-diamino-4-hydroxy-5-oxopentanoic acid (non-preferred name)

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).