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BioLiP

PDB CCD ID: M0H
Number of entries in BioLiP: 0
Chemical formula: C4 H9 N O3 S
InChI: InChI=1S/C4H9NO3S/c5-3(4(7)8)1-9-2-6/h3,6H,1-2,5H2,(H,7,8)/t3-/m0/s1
InChIKey: FOTRPRWMLKFGLW-VKHMYHEASA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.5.0C(C(C(=O)O)N)SCO
OpenEye OEToolkits 1.5.0C([C@@H](C(=O)O)N)SCO
CACTVS 3.341N[CH](CSCO)C(O)=O
CACTVS 3.341N[C@@H](CSCO)C(O)=O
ACDLabs 10.04O=C(O)C(N)CSCO
Name:S-(HYDROXYMETHYL)-L-CYSTEINE
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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