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BioLiP

PDB CCD ID: QM8
Number of entries in BioLiP: 0
Chemical formula: C6 H13 N O2 S
InChI: InChI=1S/C6H13NO2S/c7-5(6(8)9)3-1-2-4-10/h5,10H,1-4,7H2,(H,8,9)/t5-/m0/s1
InChIKey: HBMWPJLCTYKAGL-YFKPBYRVSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 3.1.0.0C(CCS)CC(C(=O)O)N
CACTVS 3.385N[CH](CCCCS)C(O)=O
CACTVS 3.385N[C@@H](CCCCS)C(O)=O
OpenEye OEToolkits 3.1.0.0C(CCS)C[C@@H](C(=O)O)N
Name:6-Sulfanyl-L-norleucine;
(2S)-2-azanyl-6-sulfanyl-hexanoic acid;
6-mercaptonorleucine
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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