Reaction Details Report a problem with these data
Target
Cell division protein ZipA
Ligand
BDBM50162319
Substrate
n/a
Meas. Tech.
ChEMBL_466596 (CHEMBL925856)
Ki
12000±n/a nM
Citation
 Wells, JA; McClendon, CL Reaching for high-hanging fruit in drug discovery at protein-protein interfaces. Nature 450:1001-1009 (2007) [PubMed]  Article 
Target
Name:
Cell division protein ZipA
Synonyms:
ZIPA_ECOLI | zipA
Type:
PROTEIN
Mol. Mass.:
36470.34
Organism:
Escherichia coli (strain K12)
Description:
ChEMBL_466596
Residue:
328
Sequence:
MMQDLRLILIIVGAIAIIALLVHGFWTSRKERSSMFRDRPLKRMKSKRDDDSYDEDVEDDEGVGEVRVHRVNHAPANAQEHEAARPSPQHQYQPPYASAQPRQPVQQPPEAQVPPQHAPHPAQPVQQPAYQPQPEQPLQQPVSPQVAPAPQPVHSAPQPAQQAFQPAEPVAAPQPEPVAEPAPVMDKPKRKEAVIIMNVAAHHGSELNGELLLNSIQQAGFIFGDMNIYHRHLSPDGSGPALFSLANMVKPGTFDPEMKDFTTPGVTIFMQVPSYGDELQNFKLMLQSAQHIADEVGGVVLDDQRRMMTPQKLREYQDIIREVKDANA
  
Inhibitor
Name:
BDBM50162319
Synonyms:
2-(4-(4-(2-(3-chloro-4-methylphenylamino)pyrimidin-4-yl)pyridin-2-yl)piperazin-1-yl)ethanaminium | 2-(4-{4-[2-(3-Chloro-4-methyl-phenylamino)-pyrimidin-4-yl]-pyridin-2-yl}-piperazin-1-yl)-ethyl-ammonium
Type:
Small organic molecule
Emp. Form.:
C22H27ClN7
Mol. Mass.:
424.949
SMILES:
Cc1ccc(Nc2nccc(n2)-c2ccnc(c2)N2CCN(CC[NH3+])CC2)cc1Cl
Structure:
Search PDB for entries with ligand similarity: