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BioLiP

PDB CCD ID: 3K0
Number of entries in BioLiP: 3
Chemical formula: C5 H10 N2 O6 S
InChI: InChI=1S/C5H10N2O6S/c6-14(12,13)7-3(5(10)11)1-2-4(8)9/h3,7H,1-2H2,(H,8,9)(H,10,11)(H2,6,12,13)/t3-/m0/s1
InChIKey: ZYYFXKZXQCQRTJ-VKHMYHEASA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.9.2C(CC(=O)O)[C@@H](C(=O)O)NS(=O)(=O)N
CACTVS 3.385N[S](=O)(=O)N[C@@H](CCC(O)=O)C(O)=O
OpenEye OEToolkits 1.9.2C(CC(=O)O)C(C(=O)O)NS(=O)(=O)N
ACDLabs 12.01O=S(=O)(NC(C(=O)O)CCC(=O)O)N
CACTVS 3.385N[S](=O)(=O)N[CH](CCC(O)=O)C(O)=O
Name:N-sulfamoyl-L-glutamic acid
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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