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BioLiP

PDB CCD ID: 4AK
Number of entries in BioLiP: 0
Chemical formula: C6 H14 N2 O5 S
InChI: InChI=1S/C6H14N2O5S/c7-5(6(9)10)3-1-2-4-8-14(11,12)13/h5,8H,1-4,7H2,(H,9,10)(H,11,12,13)/t5-/m0/s1
InChIKey: DROHJWVHGIXSPP-YFKPBYRVSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385N[CH](CCCCN[S](O)(=O)=O)C(O)=O
ACDLabs 12.01O=S(=O)(O)NCCCCC(C(=O)O)N
OpenEye OEToolkits 1.9.2C(CCNS(=O)(=O)O)C[C@@H](C(=O)O)N
CACTVS 3.385N[C@@H](CCCCN[S](O)(=O)=O)C(O)=O
OpenEye OEToolkits 1.9.2C(CCNS(=O)(=O)O)CC(C(=O)O)N
Name:N~6~-sulfo-L-lysine
ZINC: ZINC000034117198
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).
  • 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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