Ligand
Ligand Name:   monobactam L61
Ligand Type:   non-polymer
Ligand ID:   COVPDB1047 PubChem:   -
Synonym(s):   -
DrugBank:   - ChEMBL:   -
Canonical SMILES:   CC(C)COC(=O)N1[C@H](CC1=O)c2ccccc2
Standard InChI:   InChI=1S/C14H17NO3/c1-10(2)9-18-14(17)15-12(8-13(15)16)11-6-4-3-5-7-11/h3-7,10,12H,8-9H2,1-2H3/t12-/m1/s1
Molecular Formula:   C14H17NO3 Mol. Weight:   247.12085 logP:   2.7526
HBD:   0 HBA:   3
#Rotatable Bonds:   3 TPSA:   46.61

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Rhomboid protease GlpG P09391 (GLPG_ECOLI) Escherichia coli (strain K12) 3ZMJ L61 IC50 : 11710 nM PDBBind SHOW