Multiple and single binding modes of fragment-like kinase inhibitors revealed by molecular modeling, residue type-selective protonation, and nuclear overhauser effects.
第一作者:
Keith L,Constantine
第一单位:
Bristol Myers Squibb Research and Development, Princeton, New Jersey 08543, USA. keith.constantine@bms.com
作者:
医学主题词
结合部位(Binding Sites);结晶学, X线(Crystallography, X-Ray);人类(Humans);细胞内信号肽和蛋白质类(Intracellular Signaling Peptides and Proteins);异喹啉类(Isoquinolines);磁共振波谱学(Magnetic Resonance Spectroscopy);模型, 分子(Models, Molecular);分子结构(Molecular Structure);蛋白激酶抑制剂(Protein Kinase Inhibitors);质子(Protons);参考标准(Reference Standards);构效关系(Structure-Activity Relationship)
DOI
10.1021/jm800747w
PMID
18771253
发布时间
2021-12-03
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