BDBM103982 LecB Inhibitor Ligand 6
SMILES: CC1O[C@@H](OCCNC(=S)Nc2ccc(c(c2)C(O)=O)-c2c3ccc(O)cc3oc3cc(=O)ccc23)[C@@H](O)C(O)[C@@H]1O
InChI Key: InChIKey=PNZXHHORIJRZRG-FTCYFBLSSA-N
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
LecB (Pseudomonas aeruginosa) | BDBM103982 (LecB Inhibitor Ligand 6) | PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | 2.74E+3 | n/a | 697 | n/a | n/a | n/a | n/a |
University of Konstanz | ACS Chem Biol 8: 1775-84 (2013) Article DOI: 10.1021/cb400371r BindingDB Entry DOI: 10.7270/Q21J98C3 | ||||||||||||
More data for this Ligand-Target Pair |