BioLiP

PDB

BioLiP

PDB CCD ID:

ORD

Number of entries in BioLiP:

Chemical formula:

C5 H12 N2 O2

InChI:

InChI=1S/C5H12N2O2/c6-3-1-2-4(7)5(8)9/h4H,1-3,6-7H2,(H,8,9)/t4-/m1/s1

InChIKey:

AHLPHDHHMVZTML-SCSAIBSYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 1.6.1	C(C[C@H](C(=O)O)N)CN
CACTVS 3.352	NCCC[CH](N)C(O)=O
ACDLabs 10.04	O=C(O)C(N)CCCN
CACTVS 3.352	NCCC[C@@H](N)C(O)=O
OpenEye OEToolkits 1.6.1	C(CC(C(=O)O)N)CN

Name:

D-ORNITHINE

ChEMBL:

CHEMBL103686

ZINC:

ZINC000001532678

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).