BDBM36385 (3S,4R,5R)-3,4-Dihydroxy-5-(hydroxymethyl)piperidin-2-one, 6::CID448980
SMILES: OC[C@H]1CNC(=O)[C@@H](O)[C@@H]1O
InChI Key: InChIKey=ARBXEMIAJIJEQI-WDCZJNDASA-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 |
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Beta-mannosidase (Bacteroides thetaiotaomicron) | BDBM36385 ((3S,4R,5R)-3,4-Dihydroxy-5-(hydroxymethyl)piperidi...) | PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet | MMDB PC cid PC sid PDB UniChem | PDB Article PubMed | 1.10E+4 | -7.03 | n/a | n/a | n/a | n/a | n/a | 5.6 | 37 |
The Medical School, Newcastle University | Assay Description Putative mannosidase assay using wild-type protein Btman2A. Enzyme inhibition assay. | Nat Chem Biol 4: 306-12 (2008) Article DOI: 10.1038/nchembio.81 BindingDB Entry DOI: 10.7270/Q2X34VS6 | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) |