7RKR

Naegleria fowleri CYP51 (NfCYP51) complex with (S)-1-(4-fluorophenyl)-2-(1H-imidazol-1-yl)ethyl 3-(trifluoromethyl)benzoate

7RKR の概要

• エントリーDOI: 10.2210/pdb7rkr/pdb
• 分子名称: Protein CYP51, PROTOPORPHYRIN IX CONTAINING FE, (1S)-1-(4-fluorophenyl)-2-(1H-imidazol-1-yl)ethyl 3-(trifluoromethyl)benzoate, ... (5 entities in total)
• 機能のキーワード: ergosterol biosynthesis, oxidoreductase, azole inhibitors
• 由来する生物種: Naegleria fowleri (Brain eating amoeba)
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 54634.96

構造登録者

Sharma, V.,Podust, L.M. (登録日: 2021-07-22, 公開日: 2022-07-27, 最終更新日: 2023-12-27)

• 主引用文献: Sharma, V.,Madia, V.N.,Tudino, V.,Nguyen, J.V.,Debnath, A.,Messore, A.,Ialongo, D.,Patacchini, E.,Palenca, I.,Basili Franzin, S.,Seguella, L.,Esposito, G.,Petrucci, R.,Di Matteo, P.,Bortolami, M.,Saccoliti, F.,Di Santo, R.,Scipione, L.,Costi, R.,Podust, L.M.; Miconazole-like Scaffold is a Promising Lead for Naegleria fowleri -Specific CYP51 Inhibitors.; J.Med.Chem., 2023; PubMed: 38085955; DOI: 10.1021/acs.jmedchem.3c01898

実験手法

X-RAY DIFFRACTION (1.76 Å)