Ligand
Ligand Name:   phosphonooxy-[[[4-(1~{H}-1,2,3,4-tetrazol-5-yl)phenyl]sulfonylamino]methyl]borinic acid
Ligand Type:   non-polymer
Ligand ID:   COVPDB468 PubChem:   -
Synonym(s):   -
DrugBank:   - ChEMBL:   -
Canonical SMILES:   OB(CNS(=O)(=O)c1ccc(cc1)-c1nnn[nH]1)OP(O)(O)=O
Standard InChI:   InChI=1S/C8H11BN5O7PS/c15-9(21-22(16,17)18)5-10-23(19,20)7-3-1-6(2-4-7)8-11-13-14-12-8/h1-4,10,15H,5H2,(H2,16,17,18)(H,11,12,13,14)
Molecular Formula:   C8H11BN5O7PS Mol. Weight:   363.021 logP:   -1.726
HBD:   5 HBA:   8
#Rotatable Bonds:   7 TPSA:   187.62

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Beta-lactamase Q6DRA1 (Q6DRA1_ACIBA) Acinetobacter baumannii 5WAC A1M Ki : 38 nM PDBBind SHOW