BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
Cell Reactant:Tubulin
Syringe Reactant:BDBM50035218
Meas. Tech.:Enzyme Inhibition
Entry Date:04/06/17
 
ΔG°:-260±2 (kcal/mole)
pH:n/a
Log10Kb:3.95± 3.31
Temperature:303.15±0 (K)
ΔH° :-186±0 (kcal/mole)
ΔHobs:n/a
Ionic Strength:n/a
Corrected for ΔHioniz:n/a
Protons Released:n/a
ΔCp :n/a
Stoich. Param.:n/a
ΔS° :0.25±0 (kcal/mole-K)
Comments:n/a
 
Citation Zhao, WZhou, CGuan, ZYYin, PChen, FTang, YJ Structural Insights into the Inhibition of Tubulin by the Antitumor Agent 4ß-(1,2,4-triazol-3-ylthio)-4-deoxypodophyllotoxin. ACS Chem Biol12:746-752 (2017) [PubMed]  Article
More Info.:  Get all data from this article ,  ITC RUN data
 
Tubulin
Source:n/a
Purity:n/a
Prep. Method:n/a
Name:Tubulin alpha-1B chain
Synonyms:TBA1B_BOVIN | Tubulin
Type:Protein
Mol. Mass.:50133.43
Organism:Bos taurus (Bovine)
Description:P81947
Residue:451
Sequence:
MRECISIHVGQAGVQIGNACWELYCLEHGIQPDGQMPSDKTIGGGDDSFNTFFSETGAGK
HVPRAVFVDLEPTVIDEVRTGTYRQLFHPEQLITGKEDAANNYARGHYTIGKEIIDLVLD
RIRKLADQCTGLQGFLVFHSFGGGTGSGFTSLLMERLSVDYGKKSKLEFSIYPAPQVSTA
VVEPYNSILTTHTTLEHSDCAFMVDNEAIYDICRRNLDIERPTYTNLNRLISQIVSSITA
SLRFDGALNVDLTEFQTNLVPYPRIHFPLATYAPVISAEKAYHEQLSVAEITNACFEPAN
QMVKCDPRHGKYMACCLLYRGDVVPKDVNAAIATIKTKRSIQFVDWCPTGFKVGINYQPP
TVVPGGDLAKVQRAVCMLSNTTAIAEAWARLDHKFDLMYAKRAFVHWYVGEGMEEGEFSE
AREDMAALEKDYEEVGVDSVEGEGEEEGEEY
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50035218
Source:n/a
Purity:n/a
Prep. Method:n/a
NameBDBM50035218
Synonyms:CHEMBL61 | PODOFILOX | Podophyllinic acid lactone | Podophyllotoxin (PTOX) | podophyllotoxin
TypeSmall organic molecule
Emp. Form.C22H22O8
Mol. Mass.414.4053
SMILESCOc1cc(cc(OC)c1OC)[C@H]1[C@@H]2[C@H](COC2=O)[C@@H](O)c2cc3OCOc3cc12 |r|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least:

   
    

Home

|

Search

|

Deposit

|

SiteMap

|

About us

|

Email us

|

Info

 
Last update November 1, 2007
©2000 BindingDB. All rights reserved.