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TargetCalcium-dependent protein kinase 1
LigandBDBM36347
Substrate/CompetitorMTIP
Meas. Tech.Parasite Proliferation Assay
pH7.5±0
Temperature297.15±0 K
EC50>10000±0 nM
Citation Kato, NSakata, TBreton, GLe Roch, KGNagle, AAndersen, CBursulaya, BHenson, KJohnson, JKumar, KAMarr, FMason, DMcNamara, CPlouffe, DRamachandran, VSpooner, MTuntland, TZhou, YPeters, ECChatterjee, ASchultz, PGWard, GEGray, NHarper, JWinzeler, EA Gene expression signatures and small-molecule compounds link a protein kinase to Plasmodium falciparum motility. Nat Chem Biol4:347-56 (2008) [PubMed]  Article
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Calcium-dependent protein kinase 1
Name:Calcium-dependent protein kinase 1
Synonyms:Calcium-dependent protein kinase 1 | PfCDPK1
Type:PROTEIN
Mol. Mass.:60804.87
Organism:Plasmodium Falciparum
Description:P62343
Residue:524
Sequence:
MGCSQSSNVKDFKTRRSKFTNGNNYGKSGNNKNSEDLAINPGMYVRKKEGKIGESYFKVR
KLGSGAYGEVLLCREKHGHGEKAIKVIKKSQFDKMKYSITNKIECDDKIHEEIYNEISLL
KSLDHPNIIKLFDVFEDKKYFYLVTEFYEGGELFEQIINRHKFDECDAANIMKQILSGIC
YLHKHNIVHRDIKPENILLENKHSLLNIKIVDFGLSSFFSKDNKLRDRLGTAYYIAPEVL
RKKYNEKCDVWSCGVILYILLCGYPPFGGQNDQDIIKKVEKGKYYFDFNDWKNISEEAKE
LIKLMLTYDYNKRITAKEALNSKWIKKYANNINKSDQKTLCGALSNMRKFEGSQKLAQAA
ILFIGSKLTTLEERKELTDIFKKLDKNGDGQLDKKELIEGYNILRSFKNELGELKNVEEE
VDNILKEVDFDKNGYIEYSEFISVCMDKQILFSEERLRDAFNLFDTDKSGKITKEELANL
FGLTSISEQMWNEVLGEADKNKDNMIDFDEFVNMMHKICDNKSS
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BDBM36347
NameBDBM36347
Synonyms:CID24762177 | {4-[9-(3-Fluoro-phenyl)-2-trans-(4-hydroxy-cyclohexylamino)-9H-purin-6-ylamino]-phenyl}-piperidin-1-yl-methanone, 15
TypeSmall organic molecule
Emp. Form.C29H32FN7O2
Mol. Mass.529.6085
SMILESO[C@H]1CC[C@@H](CC1)Nc1nc(Nc2ccc(cc2)C(=O)N2CCCCC2)c2ncn(-c3cccc(F)c3)c2n1 |r,wU:4.7,wD:1.0,(-8.67,.31,;-7.34,-.46,;-7.34,-2,;-6,-2.77,;-4.67,-2,;-4.67,-.46,;-6,.31,;-3.33,-2.77,;-2,-2,;-2,-.46,;-.67,.31,;-.67,1.85,;.67,2.62,;2,1.85,;3.33,2.62,;3.33,4.16,;2,4.93,;.67,4.16,;4.67,4.93,;4.67,6.47,;6,4.16,;6,2.62,;7.34,1.85,;8.67,2.62,;8.67,4.16,;7.34,4.93,;.67,-.46,;2.13,.02,;3.04,-1.23,;2.13,-2.47,;2.9,-3.81,;2.13,-5.14,;2.9,-6.47,;4.44,-6.47,;5.21,-5.14,;6.75,-5.14,;4.44,-3.81,;.67,-2,;-.67,-2.77,)|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least:
MTIP
Name:MTIP
Synonyms:PFL2225w
Type:Substrate
Mol. Mass.:23466.36
Organism:Plasmodium falciparum
Description:Q8I4W8
Residue:204
Sequence:
MKQECNVCYFNLPDPESTLGPYDNELNYFTWGPGFEYEPEPQRKPLSIEESFENSEESEE
SVADIQQLEEKVDESDVRIYFNEKSSGGKISIDNASYNARKLGLAPSSIDEKKIKELYGD
NLTYEQYLEYLSICVHDKDNVEELIKMFAHFDNNCTGYLTKSQMKNILTTWGDALTDQEA
IDALNAFSSEDNIDYKLFCEDILQ
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