Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetBIR2
LigandBDBM242595
Substrate/Competitorn/a
Meas. Tech.TR-FRET Assay for BIR2 and BIR3
pH7.5±n/a
Temperature298.15±n/a K
IC50 6.28±n/a nM
Commentsextracted
Citation Chen, SDonnell, AFKester, RFLe, KLou, YMichoud, CRemiszewski, SRupert, KCWeisel, M Tetrahydro-benzodiazepinones US Patent US10053431 Publication Date 8/21/2018
More Info.:Get all data from this article,  Assay Method
 
BIR2
Name:BIR2
Synonyms:6x Histidine-tagged BIR2 domain | amino acids 124-240 of XIAP
Type:Enzyme Catalytic Domain
Mol. Mass.:14676.71
Organism:Homo sapiens (Human)
Description:n/a
Residue:125
Sequence:
MRHHHHHHRDHFALDRPSETHADYLLRTGQVVDISDTIYPRNPAMYSEEARLKSFQNWPD
YAHLTPRELASAGLYYTGIGDQVQCFACGGKLKNWEPGDRAWSEHRRHFPNCFFVLGRNL
NIRSE
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM242595
NameBDBM242595
Synonyms:(S)-N-((S)-5-(4-acetylbenzoyl)-1-((1-(2- cyanophenyl)-1H-indazol-3-yl)methyl)-2- oxo-2,3,4,5-tetrahydro-1H- benzo[b][1,4]diazepin-3-yl)-2- (methylamino)propanamide 2,2,2- trifluoroacetate | US10053431, 120
TypeSmall organic molecule
Emp. Form.C37H33N7O4
Mol. Mass.639.7024
SMILESCN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccc(cc2)C(C)=O)c2ccccc2N(Cc2nn(-c3ccccc3C#N)c3ccccc23)C1=O |r|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least:
n/a