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PDB code 5MUE

Compile Data Set for Download or QSAR

Identical Ligands in BindingDB

Found 1 hit Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Alpha-tocopherol transfer protein

  (228/228 = 100%)
(Homo sapiens)
BDBM50458513
PNG
(Alpha Tocopherol | Aquasol E | CHEBI:18145 | E307 ...)
Show SMILES CC(C)CCC[C@@H](C)CCC[C@@H](C)CCC[C@]1(C)CCc2c(C)c(O)c(C)c(C)c2O1
Show InChI InChI=1S/C29H50O2/c1-20(2)12-9-13-21(3)14-10-15-22(4)16-11-18-29(8)19-17-26-25(7)27(30)23(5)24(6)28(26)31-29/h20-22,30H,9-19H2,1-8H3/t21-,22-,29-/m1/s1
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PC cid
PC sid
PDB
UniChem
PDB
Article
PubMed
n/an/an/a 2.40n/an/an/an/an/a



Universidad de la Rep£blica

Curated by ChEMBL


Assay Description
Displacement of NBD-Toc from human recombinant alphaTTP


Bioorg Med Chem 17: 8143-8 (2009)


Article DOI: 10.1016/j.bmc.2009.10.046
BindingDB Entry DOI: 10.7270/Q2K93BBR
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)

Search BindingMOAD for More Affinity Data:

* indicates data uncertainty>20%
* 0.9 Tanimoto similarity
Identities from BLAST output