SEQ2FUN

BioLiP

PDB CCD ID: HOZ
Number of entries in BioLiP: 6
Chemical formula: C5 H12 N2 O2
InChI: InChI=1S/C5H12N2O2/c6-3-4(7)1-2-5(8)9/h4H,1-3,6-7H2,(H,8,9)/t4-/m0/s1
InChIKey: PQGAAJQIFBEYSA-BYPYZUCNSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.5.0C(CC(=O)O)[C@@H](CN)N
OpenEye OEToolkits 1.5.0C(CC(=O)O)C(CN)N
CACTVS 3.341NC[CH](N)CCC(O)=O
CACTVS 3.341NC[C@@H](N)CCC(O)=O
ACDLabs 10.04O=C(O)CCC(N)CN
Name:(4S)-4,5-DIAMINOPENTANOIC ACID
ZINC: ZINC000038792051
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).