BioLiP

PDB

BioLiP

PDB CCD ID:

A1BDE

Number of entries in BioLiP:

Chemical formula:

C9 H19 N3 O4

InChI:

InChI=1S/C9H19N3O4/c10-6(9(15)16)3-1-2-4-12-8(14)7(11)5-13/h6-7,13H,1-5,10-11H2,(H,12,14)(H,15,16)/t6-,7-/m0/s1

InChIKey:

XMXRWVAGRXQGGI-BQBZGAKWSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 3.1.0.0	C(CCNC(=O)C(CO)N)CC(C(=O)O)N
CACTVS 3.385	N[CH](CO)C(=O)NCCCC[CH](N)C(O)=O
OpenEye OEToolkits 3.1.0.0	C(CCNC(=O)[C@H](CO)N)C[C@@H](C(=O)O)N
CACTVS 3.385	N[C@@H](CO)C(=O)NCCCC[C@H](N)C(O)=O
ACDLabs 14.52	O=C(NCCCCC(N)C(=O)O)C(N)CO

Name:

N~6~-L-seryl-L-lysine

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).