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BioLiP Library

PDB CCD ID: 3GL
Number of entries in BioLiP: 0
Chemical formula: C5 H9 N O5
InChI: InChI=1S/C5H9NO5/c6-2(4(8)9)1-3(7)5(10)11/h2-3,7H,1,6H2,(H,8,9)(H,10,11)/t2-,3-/m0/s1
InChIKey: HBDWQSHEVMSFGY-HRFVKAFMSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.6.1C(C(C(=O)O)N)C(C(=O)O)O
ACDLabs 10.04O=C(O)C(N)CC(O)C(=O)O
OpenEye OEToolkits 1.6.1C([C@@H](C(=O)O)N)[C@@H](C(=O)O)O
CACTVS 3.352N[CH](C[CH](O)C(O)=O)C(O)=O
CACTVS 3.352N[C@@H](C[C@H](O)C(O)=O)C(O)=O
Name:(2S,4S)-2-amino-4-hydroxy-pentanedioic acid;
4-HYDROXY-GLUTAMIC-ACID
ChEMBL: CHEMBL197110
ZINC: ZINC000000901639
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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