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BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP Tara-3D TM-fold DECOYS POTENTIAL RW/RWplus EvoEF HPSF THE-DB ADDRESS Alpaca-Antibody CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13 CASP14

BioLiP Library

PDB CCD ID: UXS
Number of entries in BioLiP: 0
Chemical formula: C5 H13 N O S
InChI: InChI=1S/C5H13NOS/c1-8-3-2-5(6)4-7/h5,7H,2-4,6H2,1H3/t5-/m0/s1
InChIKey: MIQJGZAEWQQAPN-YFKPBYRVSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385CSCC[CH](N)CO
ACDLabs 12.01C(C(N)CCSC)O
OpenEye OEToolkits 2.0.7CSCC[C@@H](CO)N
OpenEye OEToolkits 2.0.7CSCCC(CO)N
CACTVS 3.385CSCC[C@H](N)CO
Name:(2S)-2-amino-4-(methylsulfanyl)butan-1-ol
ZINC: ZINC000001694668

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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