Ligand
Ligand Name:   Lactivicin
Ligand Type:   non-polymer
Ligand ID:   COVPDB1046 PubChem:   9816929
Synonym(s):  
  •   schembl14602372
DrugBank:   - ChEMBL:   CHEMBL575528
Canonical SMILES:   CC(=O)N[C@H]1CON(C1=O)[C@@]1(CCC(=O)O1)C(O)=O
Standard InChI:   InChI=1S/C10H12N2O7/c1-5(13)11-6-4-18-12(8(6)15)10(9(16)17)3-2-7(14)19-10/h6H,2-4H2,1H3,(H,11,13)(H,16,17)/t6-,10+/m0/s1
Molecular Formula:   C10H12N2O7 Mol. Weight:   272.06445 logP:   -1.6172
HBD:   2 HBA:   6
#Rotatable Bonds:   3 TPSA:   122.24

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Beta-lactamase P94458 (P94458_BACLI) Bacillus licheniformis 2X71 L4C
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