Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetEndochitinase
LigandBDBM50331852
Substrate/Competitorn/a
Meas. Tech.ChEMBL_686887 (CHEMBL1291256)
Ki 340000±n/a nM
Citation Schüttelkopf, AWGros, LBlair, DEFrearson, JAvan Aalten, DMGilbert, IH Acetazolamide-based fungal chitinase inhibitors. Bioorg Med Chem18:8334-40 (2010) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Endochitinase
Name:Endochitinase
Synonyms:CHIT_YEAST | CTS1 | SCW2 | Soluble cell wall protein 2
Type:PROTEIN
Mol. Mass.:58992.99
Organism:Saccharomyces cerevisiae
Description:ChEMBL_686887
Residue:562
Sequence:
MSLLYIILLFTQFLLLPTDAFDRSANTNIAVYWGQNSAGTQESLATYCESSDADIFLLSF
LNQFPTLGLNFANACSDTFSDGLLHCTQIAEDIETCQSLGKKVLLSLGGASGSYLFSDDS
QAETFAQTLWDTFGEGTGASERPFDSAVVDGFDFDIENNNEVGYSALATKLRTLFAEGTK
QYYLSAAPQCPYPDASVGDLLENADIDFAFIQFYNNYCSVSGQFNWDTWLTYAQTVSPNK
NIKLFLGLPGSASAAGSGYISDTSLLESTIADIASSSSFGGIALWDASQAFSNELNGEPY
VEILKNLLTSASQTATTTVATSKTSAASTSSASTSSASTSQKKTTQSTTSTQSKSKVTLS
PTASSAIKTSITQTTKTLTSSTKTKSSLGTTTTESTLNSVAITSMKTTLSSQITSAALVT
PQTTTTSIVSSAPIQTAITSTLSPATKSSSVVSLQTATTSTLSPTTTSTSSGSTSSGSTS
SDSTARTLAKELNAQYAAGKLNGKSTCTEGEIACSADGKFAVCDHSAWVYMECASGTTCY
AYDSGDSVYTQCNFSYLESNYF
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50331852
n/a
NameBDBM50331852
Synonyms:8-CHLORO-1,3-DIMETHYL-3,7-DIHYDRO-1H-PURINE-2,6-DIONE | 8-Chloro-1,3-dimethyl-3,7-dihydro-purine-2,6-dione | 8-Chloro-theophylline | CHEMBL88611
TypeSmall organic molecule
Emp. Form.C7H7ClN4O2
Mol. Mass.214.609
SMILESCn1c2nc(Cl)[nH]c2c(=O)n(C)c1=O
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: