BindingDB logo
myBDB logout

BDBM213228 Inositol 1,3,4,5,6-pentakisphosphate (IP5)

SMILES: O[C@@H]1[C@H](OP([O-])([O-])=O)[C@@H](OP([O-])([O-])=O)[C@H](OP([O-])([O-])=O)[C@@H](OP([O-])([O-])=O)[C@@H]1OP([O-])([O-])=O

InChI Key: InChIKey=CTPQAXVNYGZUAJ-KXXVROSKSA-D

Data: 1 Kd  1 ITC

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 213228   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Inositol 1,3,4,5,6-pentakisphosphate 2-kinase (IPK1)


(Arabidopsis thaliana (Mouse-ear cress))
BDBM213228
PNG
(Inositol 1,3,4,5,6-pentakisphosphate (IP5))
Show SMILES O[C@@H]1[C@H](OP([O-])([O-])=O)[C@@H](OP([O-])([O-])=O)[C@H](OP([O-])([O-])=O)[C@@H](OP([O-])([O-])=O)[C@@H]1OP([O-])([O-])=O
Show InChI InChI=1S/C6H17O21P5/c7-1-2(23-28(8,9)10)4(25-30(14,15)16)6(27-32(20,21)22)5(26-31(17,18)19)3(1)24-29(11,12)13/h1-7H,(H2,8,9,10)(H2,11,12,13)(H2,14,15,16)(H2,17,18,19)(H2,20,21,22)/p-10/t1-,2+,3-,4-,5+,6+
PDB

UniProtKB/SwissProt

GoogleScholar
Purchase

KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 600n/an/an/a7.525



McGill University



Assay Description
Experiments were performed on a MicroCal iTC200 titration calorimeter (GE Healthcare). Wild-type IPK1 was purified and dialyzed into ITC buffer conta...


J Biol Chem 288: 26908-13 (2013)


Article DOI: 10.1074/jbc.M113.487777
BindingDB Entry DOI: 10.7270/Q2QC02B7
More data for this
Ligand-Target Pair

Activity Spreadsheet -- ITC Data from BindingDB

Found 1 hit for monomerid = 213228
Cell (A)Syringe (B)Cell
Links
Syringe
Links
Cell + Syr
Links
ΔG°
kcal/mole
-TΔS°
kcal/mole
ΔH°
kcal/mole
log KpHTemp
°C
Inositol 1,3,4,5,6-pentakisphosphate 2-kinase (IPK1)

(Arabidopsis thaliana (Mouse-ear cress))
BDBM213228
JPEG
(Inositol 1,3,4,5,6-pentakisphosphate (IP5))
GoogleScholar
PDB
KEGG
PC cid
PC sid
-8.503.40-11.96.237.525



McGill University





J Biol Chem 288: 26908-13 (2013)