Ontology highlight
ABSTRACT:
SUBMITTER: Yuan Y
PROVIDER: S-EPMC5408253 | biostudies-literature | 2017 Apr
REPOSITORIES: biostudies-literature
Yuan Yongze Y Han Rui R Cao Qianwen Q Yu Jinhui J Mao Jiali J Zhang Tingfu T Wang Shengqiang S Niu Yuhui Y Liu Deli D
Marine drugs 20170405 4
Sterol 14α-demethylases from Cytochrome P450 family (CYP51s) are essential enzymes in sterol biosynthesis and well-known as the target of antifungal drugs. The 3D structure of CYP51A from <i>Penicillium italicum</i> (PiCYP51A) was constructed through homology modeling based on the crystal structure of human CYP51A (PDB: 3LD6). Molecular dynamics (MD) simulation was operated to relax the initial model and followed by quality assessment using PROCHECK program. On the basis of the docking informati ...[more]