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BioLiP Library

PDB CCD ID: 9AT
Number of entries in BioLiP: 0
Chemical formula: C4 H10 N2 O2
InChI: InChI=1S/C4H10N2O2/c1-2(7)3(5)4(6)8/h2-3,7H,5H2,1H3,(H2,6,8)/t2-,3+/m1/s1
InChIKey: PZUOEYPTQJILHP-GBXIJSLDSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.6.1C[C@H]([C@@H](C(=O)N)N)O
CACTVS 3.352C[C@@H](O)[C@H](N)C(N)=O
OpenEye OEToolkits 1.6.1CC(C(C(=O)N)N)O
CACTVS 3.352C[CH](O)[CH](N)C(N)=O
Name:(2S,3R)-2-amino-3-hydroxy-butanamide;
AMIDATED THREONINE
ZINC: ZINC000002046871
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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