Computational design and discovery of conformationally flexible inhibitors of acetohydroxyacid synthase to overcome drug resistance associated with the W586L mutation.
Ji
Feng-Qin
FQ
Key Laboratory of Pesticide & Chemical Biology, Ministry of Education, College of Chemistry, Central China Normal University, Hubei, Wuhan 430079, PR China.
Niu
Cong-Wei
CW
Chen
Chao-Nan
CN
Chen
Qiong
Q
Yang
Guang-Fu
GF
Xi
Zhen
Z
Zhan
Chang-Guo
CG
D000095:Acetolactate Synthase / Q000037:antagonists & inhibitors* / Q000737:chemistry / Q000235:genetics / Q000378:metabolism*; D019295:Computational Biology; D015195:Drug Design; D004351:Drug Resistance / Q000187:drug effects* / Q000235:genetics*; D004791:Enzyme Inhibitors / Q000737:chemistry* / Q000494:pharmacology*; D007700:Kinetics; D007930:Leucine / Q000235:genetics / Q000378:metabolism; D008958:Models, Molecular; D008968:Molecular Conformation; D009154:Mutation / Q000235:genetics; D014364:Tryptophan / Q000235:genetics / Q000378:metabolism
D004791:Enzyme Inhibitors; D014364:Tryptophan; D000095:Acetolactate Synthase; D007930:Leucine