Ligand
Ligand Name:   N-(tert-butoxycarbonyl)-L-alanyl-N-[(1R)-1-(dihydroxyboranyl)-2-methylpropyl]-L-prolinamide
Ligand Type:   non-polymer
Ligand ID:   COVPDB15 PubChem:   -
Synonym(s):   -
DrugBank:   - ChEMBL:   -
Canonical SMILES:   CC(C)[C@@H](B(O)O)N(C(=O)[C@H](C)NC(=O)OC(C)(C)C)C(=O)[C@@H]1CCCN1
Standard InChI:   InChI=1S/C17H32BN3O6/c1-10(2)13(18(25)26)21(15(23)12-8-7-9-19-12)14(22)11(3)20-16(24)27-17(4,5)6/h10-13,19,25-26H,7-9H2,1-6H3,(H,20,24)/t11-,12-,13-/m0/s1
Molecular Formula:   C17H32BN3O6 Mol. Weight:   385.2384 logP:   0.0434
HBD:   4 HBA:   7
#Rotatable Bonds:   6 TPSA:   128.2

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Alpha-lytic protease P00778 (PRLA_LYSEN) Lysobacter enzymogenes 1P01 0EG Ki : 0.35 nM PDBBind SHOW