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Target
Putative heat shock protein HSP 90-alpha A4
Ligand
BDBM50008059
Substrate
n/a
Meas. Tech.
Fluorescence Polarization Assay (FPA)
pH
7.3±n/a
IC50
1.4e+2±n/a nM
Comments
extracted
Citation
 Li, Z; Jia, L; Wang, J; Wu, X; Shi, G; Lu, C; Shen, Y Discovery of novel 17-phenylethylaminegeldanamycin derivatives as potent Hsp90 inhibitors. Chem Biol Drug Des 85:181-8 (2015) [PubMed]  Article
Target
Name:
Putative heat shock protein HSP 90-alpha A4
Synonyms:
HS904_HUMAN | HSP90AA4P | HSP90AD | HSPCAL2 | Heat-shock protein 90 (Hsp90)
Type:
Protein
Mol. Mass.:
47697.69
Organism:
Homo sapiens (Human)
Description:
n/a
Residue:
418
Sequence:
MESLTDPSKLDSGKEPHISLIPNKQDRTLTIVDTGIGMTKADLINNLGTITKSETKVFMEVLQAGADISMIGQFSVGFYSAYSVAEKVTVITKHNNDEQYAWESSLRGSFTEYREFYKSLTINWEDYLAVKHFSVEGQLEFRAFLFVPRLAPFELLETRKKKNKIKLSARRDLIMDNCEELIPEYLNFIRGVVDSEDLPLNIFRETKDQVANSTIVQRLWKHGLEVIYTIEPIDEYCVQQLKEFEGKTLVSVTKEDLELPEDEEEKKKQEEGKQKTKQKKNQSLRTSAKSTYGWTANMERIMKAQALRDNSTTGYMAAKKHLEINPDHSFIDTLRQKAETDKNDKSVKDLVILLYETALLSSDFGLEGPQTHANRIYRMNKLGLGTDEDDPTADDTSAAVTEEMPPLEGDDDTSRMEK
  
Inhibitor
Name:
BDBM50008059
Synonyms:
CHEBI:5292 | GELDANAMYCIN
Type:
Small organic molecule
Emp. Form.:
C29H40N2O9
Mol. Mass.:
560.6359
SMILES:
CO[C@H]1C[C@H](C)CC2=C(OC)C(=O)C=C(NC(=O)\C(C)=C\C=C/[C@H](OC)[C@@H](OC(N)=O)\C(C)=C\[C@H](C)[C@H]1O)C2=O |r,c:7,21,t:13,19,32|
Structure:
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