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TargetHistone deacetylase
LigandBDBM50366738
Substrate/Competitorn/a
Meas. Tech.ChEBML_79057
IC50 0.200000±n/a nM
Citation Colletti, SLMyers, RWDarkin-Rattray, SJGurnett, AMDulski, PMGaluska, SAllocco, JJAyer, MBLi, CLim, JCrumley, TMCannova, CSchmatz, DMWyvratt, MJFisher, MHMeinke, PT Broad spectrum antiprotozoal agents that inhibit histone deacetylase: structure-activity relationships of apicidin. Part 2. Bioorg Med Chem Lett11:113-7 (2001) [PubMed]
More Info.:Get all data from this article,  Assay Method
 
Histone deacetylase
Name:Histone deacetylase
Synonyms:n/a
Type:PROTEIN
Mol. Mass.:50433.01
Organism:Cryptosporidium parvum
Description:ChEMBL_79057
Residue:444
Sequence:
MAKRVSYFYDGDIGSYYYGPGHPMKPQRIRMAHNLILSYDLYKHMEIYKPHKSPQSELVY
FHEEDYINFLSSINPDNSKDFGLQLKRFNLGETTDCPVFDGLFEFQQICAGGSIDGAYKL
NNEQSDICINWSGGLHHAKRSEASGFCYINDIVLGILELLKYHARVMYIDIDVHHGDGVE
EAFYLSHRVLTVSFHKFGEFFPGTGDITDIGVAQGKYYSVNVPLNDGIDDDSFLSLFKPI
ISKCIEVYRPGAIVLQCGADSVRGDRLGRFNLSIKGHAECVEFCKKFNIPLLILGGGGYT
IRNVARTWAYETATILDRTDLISDNIPLNDYYDYFAPDFKLHIPPLNLPNMNSPEHLEKI
KAKVIDNLRYLEHAPGVEFAYVPSDFFDREASNLQKQEDEEREEELSSWQGGGRAAGSTE
SQGNHNEKPKSSRKLQKEHASEFY
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50366738
n/a
NameBDBM50366738
Synonyms:CHEMBL1793985
TypeSmall organic molecule
Emp. Form.C41H55N5O7
Mol. Mass.729.9047
SMILESCC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2c([nH]c3ccccc23)-c2cc(OC)cc(OC)c2)NC(=O)[C@H](CCCCCC(=O)CC)NC(=O)[C@H]2CCCCN2C1=O
Structure
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