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TargetCoproporphyrinogen III oxidase
LigandBDBM50414836
Substrate/Competitorn/a
Meas. Tech.ChEMBL_588025 (CHEMBL1048360)
Ki 33.88±n/a nM
Citation Zhang, LHao, GFTan, YXi, ZHuang, MZYang, GF Bioactive conformation analysis of cyclic imides as protoporphyrinogen oxidase inhibitor by combining DFT calculations, QSAR and molecular dynamic simulations. Bioorg Med Chem17:4935-42 (2009) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Coproporphyrinogen III oxidase
Name:Coproporphyrinogen III oxidase
Synonyms:CGOX_BACSU | PPO | Protoporphyrinogen oxidase | cgoX | hemG | hemY
Type:PROTEIN
Mol. Mass.:51210.88
Organism:Bacillus subtilis (strain 168)
Description:ChEMBL_588025
Residue:470
Sequence:
MSDGKKHVVIIGGGITGLAAAFYMEKEIKEKNLPLELTLVEASPRVGGKIQTVKKDGYII
ERGPDSFLERKKSAPQLVKDLGLEHLLVNNATGQSYVLVNRTLHPMPKGAVMGIPTKIAP
FVSTGLFSLSGKARAAMDFILPASKTKDDQSLGEFFRRRVGDEVVENLIEPLLSGIYAGD
IDKLSLMSTFPQFYQTEQKHRSLILGMKKTRPQGSGQQLTAKKQGQFQTLSTGLQTLVEE
IEKQLKLTKVYKGTKVTKLSHSGSCYSLELDNGVTLDADSVIVTAPHKAAAGMLSELPAI
SHLKNMHSTSVANVALGFPEGSVQMEHEGTGFVISRNSDFAITACTWTNKKWPHAAPEGK
TLLRAYVGKAGDESIVDLSDNDIINIVLEDLKKVMNINGEPEMTCVTRWHESMPQYHVGH
KQRIKELREALASAYPGVYMTGASFEGVGIPDCIDQGKAAVSDALTYLFS
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  Blast E-value cutoff:
BDBM50414836
n/a
NameBDBM50414836
Synonyms:CHEMBL573877
TypeSmall organic molecule
Emp. Form.C23H16ClF4N3O5
Mol. Mass.525.837
SMILESFc1cc(Cl)c(NC(=O)NC(=O)c2cccc(OC(F)(F)F)c2)cc1N1C(=O)C2=C(CCCC2)C1=O |t:30|
Structure
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