SEQ2FUN

BioLiP

PDB CCD ID: 4FB
Number of entries in BioLiP: 0
Chemical formula: C5 H8 F N O2
InChI: InChI=1S/C5H8FNO2/c6-3-1-4(5(8)9)7-2-3/h3-4,7H,1-2H2,(H,8,9)/t3-,4-/m0/s1
InChIKey: ZIWHMENIDGOELV-IMJSIDKUSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.5.0C1C(CNC1C(=O)O)F
ACDLabs 10.04O=C(O)C1NCC(F)C1
CACTVS 3.341OC(=O)[CH]1C[CH](F)CN1
CACTVS 3.341OC(=O)[C@@H]1C[C@H](F)CN1
OpenEye OEToolkits 1.5.0C1[C@@H](CN[C@@H]1C(=O)O)F
Name:(4S)-4-FLUORO-L-PROLINE
ZINC: ZINC000002584017
Reference:
  • Chengxin Zhang, Xi Zhang, Lydia 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).