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BioLiP

PDB CCD ID: LLY
Number of entries in BioLiP: 0
Chemical formula: C9 H16 N2 O6
InChI: InChI=1S/C9H16N2O6/c10-5(7(12)13)3-1-2-4-11-6(8(14)15)9(16)17/h5-6,11H,1-4,10H2,(H,12,13)(H,14,15)(H,16,17)/t5-/m0/s1
InChIKey: XINFXVVRMYBFMI-YFKPBYRVSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.5.0C(CCNC(C(=O)O)C(=O)O)CC(C(=O)O)N
ACDLabs 10.04O=C(O)C(C(=O)O)NCCCCC(N)C(=O)O
CACTVS 3.341N[C@@H](CCCCNC(C(O)=O)C(O)=O)C(O)=O
CACTVS 3.341N[CH](CCCCNC(C(O)=O)C(O)=O)C(O)=O
OpenEye OEToolkits 1.5.0C(CCNC(C(=O)O)C(=O)O)C[C@@H](C(=O)O)N
Name:NZ-(DICARBOXYMETHYL)LYSINE
DrugBank: DB01815
ZINC: ZINC000006360448
Reference:
  • Chengxin Zhang, Xi Zhang, Peter L Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023)(download the PDF file).
  • 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).

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