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BioLiP Library

PDB CCD ID: HGA
Number of entries in BioLiP: 4
Chemical formula: C5 H10 N2 O4
InChI: InChI=1S/C5H10N2O4/c6-3(5(9)10)1-2-4(8)7-11/h3,11H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1
InChIKey: YVGZXTQJQNXIAU-VKHMYHEASA-N
SMILES:
SoftwareSMILES
CACTVS 3.341N[C@@H](CCC(=O)NO)C(O)=O
ACDLabs 10.04O=C(NO)CCC(C(=O)O)N
CACTVS 3.341N[CH](CCC(=O)NO)C(O)=O
OpenEye OEToolkits 1.5.0C(CC(=O)NO)C(C(=O)O)N
OpenEye OEToolkits 1.5.0C(CC(=O)NO)[C@@H](C(=O)O)N
Name:GLUTAMINE HYDROXAMATE
ChEMBL: CHEMBL63893
DrugBank: DB02446
ZINC: ZINC000002522574
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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