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Target
Chitin synthase 3
Ligand
BDBM152551
Substrate
n/a
Meas. Tech.
Chitin Synthase Assays
pH
7.5±n/a
Temperature
298.15±n/a K
IC50
3.000e+6±n/a nM
Comments
extracted
Citation
 Kral, K; Bieg, T; Nawrot, U; Wlodarczyk, K; Lalik, A; Hahn, P; Wandzik, I New monomeric and dimeric uridinyl derivatives as inhibitors of chitin synthase. Bioorg Chem 61:13-20 (2015) [PubMed]  Article 
Target
Name:
Chitin synthase 3
Synonyms:
CAL1 | CHS3 | CHS3_YEAST | CSD2 | Chitin synthase (CS) | DIT101 | KIT2
Type:
Protein
Mol. Mass.:
131602.23
Organism:
Saccharomyces cerevisiae (Yeast)
Description:
P29465
Residue:
1165
Sequence:
MTGLNGDDPDDYYLNLNQDEESLLRSRHSVGSGAPHRQGSLVRPERSRLNNPDNPHFYYAQKTQEQMNHLDVLPSSTGVNPNATRRSGSLRSKGSVRSKFSGRETDSYLLQDMNTTDKKASVKISDEGVAEDEFDKDGDVDNFEESSTQPINKSIKPLRKETNDTLSFWQMYCYFITFWAPAPILAFCGMPKKERQMAWREKVALISVILYIGAIVAFLTFGFTKTVCSSSKLRLKNNEVSTEFVVINGKAYELDTSSRSGIQDVEVDSDTLYGPWSDAGKDASFLFQNVNGNCHNLITPKSNSSIPHDDDNNLAWYFPCKLKNQDGSSKPNFTVENYAGWNCHTSKEDRDAFYGLKSKADVYFTWDGIKNSSRNLIVYNGDVLDLDLLDWLEKDDVDYPVVFDDLKTSNLQGYDLSLVLSNGHERKIARCLSEIIKVGEVDSKTVGCIASDVVLYVSLVFILSVVIIKFIIACYFRWTVARKQGAYIVDNKTMDKHTNDIEDWSNNIQTKAPLKEVDPHLRPKKYSKKSLGHKRASTFDLLKKHSSKMFQFNESVIDLDTSMSSSLQSSGSYRGMTTMTTQNAWKLSNENKAVHSRNPSTLLPTSSMFWNKATSSPVPGSSLIQSLDSTIIHPDIVQQPPLDFMPYGFPLIHTICFVTCYSEDEEGLRTTLDSLSTTDYPNSHKLLMVVCDGLIKGSGNDKTTPEIALGMMDDFVTPPDEVKPYSYVAVASGSKRHNMAKIYAGFYKYDDSTIPPENQQRVPIITIVKCGTPAEQGAAKPGNRGKRDSQIILMSFLEKITFDERMTQLEFQLLKNIWQITGLMADFYETVLMVDADTKVFPDALTHMVAEMVKDPLIMGLCGETKIANKAQSWVTAIQVFEYYISHHQAKAFESVFGSVTCLPGCFSMYRIKSPKGSDGYWVPVLANPDIVERYSDNVTNTLHKKNLLLLGEDRFLSSLMLKTFPKRKQVFVPKAACKTIAPDKFKVLLSQRRRWINSTVHNLFELVLIRDLCGTFCFSMQFVIGIELIGTMVLPLAICFTIYVIIFAIVSKPTPVITLVLLAIILGLPGLIVVITATRWSYLWWMCVYICALPIWNFVLPSYAYWKFDDFSWGDTRTIAGGNKKAQDENEGEFDHSKIKMRTWREFEREDILNRKEESDSFVA
  
Inhibitor
Name:
BDBM152551
Synonyms:
Dimer 15 (15)
Type:
Small organic molecule
Emp. Form.:
C26H34N8O14
Mol. Mass.:
682.5934
SMILES:
OC1[C@@H](CNC(=O)CNC(=O)CCC(=O)NCC(=O)NC[C@H]2O[C@H]([C@@H](O)C2O)n2ccc(=O)[nH]c2=O)O[C@H]([C@H]1O)n1ccc(=O)[nH]c1=O |r|
Structure:
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