BDBM199118 (2R,3R,4S,5R)-2-(6-aminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol::Adenosine

SMILES c1nc(c2c(n1)n(cn2)[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)N

InChI Key InChIKey=OIRDTQYFTABQOQ-UHFFFAOYSA-N

Data  1 Kd  1 ITC

PDB links: 210 PDB IDs match this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 199118   

Target3-phosphoinositide-dependent protein kinase 1 [50-359](Human)
Universitätsklinikum Frankfurt

LigandPNGBDBM199118(Adenosine | (2R,3R,4S,5R)-2-(6-aminopurin-9-yl)-5-...)
Affinity DataKd:  2.00E+4nMpH: 7.4Assay Description:Titrations were performed by a 0.4 µl injection followed by 19 successive injections (2 µl) of each compound(adenosine 500 µM, PS653 250 µM) into a 2...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/2/2016
Entry Details Article
PubMedPDB3D3D Structure (crystal)

Activity Spreadsheet -- ITC Data from BindingDB

Found 1 hit for monomerid = 199118   

Cell3-phosphoinositide dependent protein kinase-1(Human)
Universitätsklinikum Frankfurt

SyringePNGBDBM199118(Adenosine | (2R,3R,4S,5R)-2-(6-aminopurin-9-yl)-5-...)
ITC DataΔG°: -6.40kcal/mole −TΔS°: -3.19kcal/mole ΔH°: -3.10kcal/mole logk: 5.00E+4
T: 24.85°C