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Cell Reactant:hRXRα-LBD⋅Targretin
Syringe Reactant:BDBM217359
Meas. Tech.:Enzyme Inhibition
Entry Date:03/17/17
 
ΔG°:-36.1±0.0800 (kJ/mole)
pH:8±0
Log10Kb:6.32± n/a
Temperature:298.15±0 (K)
ΔH° :-39.6±0.0800 (kJ/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° : 0.012±0.000700 (kJ/mole-K)
Comments:n/a
 
Citation Boerma, LJXia, GQui, CCox, BDChalmers, MJSmith, CDLobo-Ruppert, SGriffin, PRMuccio, DDRenfrow, MB Defining the communication between agonist and coactivator binding in the retinoid X receptor a ligand binding domain. J Biol Chem289:814-26 (2014) [PubMed]  Article
More Info.:  Get all data from this article ,  ITC RUN data
 
hRXRα-LBD⋅Targretin
Source:n/a
Purity:n/a
Prep. Method:n/a
Name:hRXRα-LBD⋅Targretin
Synonyms:n/a
Type:Protein
Mol. Mass.:n/a
Description:n/a
Components:This complex has 2 components.
Component 1
Name:Retinoid X receptor alpha ligand-binding domain (RXRα-LBD)
Synonyms:n/a
Type:Protein
Mol. Mass.:26819.71
Organism:Homo sapiens (Human)
Description:Human RXRα ligand binding domain (Thr223-Thr462)
Residue:240
Sequence:
TSSANEDMPVERILEAELAVEPKTETYVEANMGLNPSSPNDPVTNICQAADKQLFTLVEW
AKRIPHFSELPLDDQVILLRAGWNELLIASFSHRSIAVKDGILLATGLHVHRNSAHSAGV
GAIFDRVLTELVSKMRDMQMDKTELGCLRAIVLFNPDSKGLSNPAEVEALREKVYASLEA
YCKHKYPEQPGRFAKLLLRLPALRSIGLKCLEHLFFFKLIGDTPIDTFLMEMLEAPHQMT
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  Blast E-value cutoff:
Component 2
NameBDBM50032675
Synonyms:4-[1-(3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydronaphthalen-2-yl)vinyl]benzoic acid | BEXAROTENE | CHEMBL1023 | p-(1-(5,6,7,8-Tetrahydro-3,5,5,8,8-pentamethyl-2-naphthyl)vinyl)benzoic acid
TypeSmall organic molecule
Emp. Form.C24H28O2
Mol. Mass.348.4779
SMILESCc1cc2c(cc1C(=C)c1ccc(cc1)C(O)=O)C(C)(C)CCC2(C)C
Structure
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BDBM217359
Source:n/a
Purity:n/a
Prep. Method:n/a
NameBDBM217359
Synonyms:GRIP-1 | KHKILHRLLQDSS
TypeSmall organic molecule
Emp. Form.C69H119N23O19
Mol. Mass.1574.8259
SMILESCC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(O)=O |r|
Structure
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