Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetXIAP-BIR3
LigandBDBM13166
Substrate/CompetitorSmac-based peptide
Meas. Tech.Ligand Binding Assay
pH7.4±n/a
Temperature295.15±n/a K
Kd 12±n/a nM
Citation Oost, TKSun, CArmstrong, RCAl-Assaad, ASBetz, SFDeckwerth, TLDing, HElmore, SWMeadows, RPOlejniczak, ETOleksijew, AOltersdorf, TRosenberg, SHShoemaker, ARTomaselli, KJZou, HFesik, SW Discovery of potent antagonists of the antiapoptotic protein XIAP for the treatment of cancer. J Med Chem47:4417-26 (2004) [PubMed]  Article
More Info.:Get all data from this article,   Solution Info,  Assay Method
 
XIAP-BIR3
Name:XIAP-BIR3
Synonyms:BIR3 domain of X-linked inhibitor of apoptosis protein | baculovirus IAP repeat 3 (BIR3) domain of XIAP
Type:Protein Binding Domain
Mol. Mass.:13407.81
Organism:Homo sapiens (Human)
Description:BIR3 of XIAP: RESIDUES 241-356.
Residue:117
Sequence:
MSDAVSSDRNFPNSTNLPRNPSMADYEARIFTFGTWIYSVNKEQLARAGFYALGEGDKVK
CFHCGGGLTDWKPSEDPWEQHAKWYPGCKYLLEQKGQEYINNIHLTHSLEECLVRTT
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM13166
NameBDBM13166
Synonyms:(2S)-1-[(2S)-3,3-dimethyl-2-[(2S)-2-(methylamino)propanamido]butanoyl]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrrolidine-2-carboxamide | Capped Tripeptide Analog 2 | H-N-Me-Ala-Tle-Pro-(R)-tetrahydronaphth-1-yl Amide
TypeSmall organic molecule
Emp. Form.C25H38N4O3
Mol. Mass.442.5942
SMILESCN[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H]1CCCc2ccccc12)C(C)(C)C |r|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least:
Smac-based peptide
Name:Smac-based peptide
Synonyms:6-Carboxyfluorescein (FAM) labeled peptide AVPIAQK
Type:Peptide
Mol. Mass.:1328.08
Organism:n/a
Description:n/a
Residue:12
Sequence:
AVPIAQK(FAM)-NH2