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Structure paper

TitleStructural Insights into the Molecular Design of Flutolanil Derivatives Targeted for Fumarate Respiration of Parasite Mitochondria
Journal, issue, pagesInt J Mol Sci, Vol. 16, Page 15287-15308, Year 2015
Publish dateDec 22, 2009 (structure data deposition date)
AuthorsInaoka, D.K. / Shiba, T. / Sato, D. / Balogun, E.O. / Sasaki, T. / Nagahama, M. / Oda, M. / Matsuoka, S. / Ohmori, J. / Honma, T. ...Inaoka, D.K. / Shiba, T. / Sato, D. / Balogun, E.O. / Sasaki, T. / Nagahama, M. / Oda, M. / Matsuoka, S. / Ohmori, J. / Honma, T. / Inoue, M. / Kita, K. / Harada, S.
External linksInt J Mol Sci / PubMed:26198225
MethodsX-ray diffraction
Resolution2.25 - 3.66 Å
Structure data

PDB-3abv:
Crystal structure of porcine heart mitochondrial complex II bound with N-Biphenyl-3-yl-2-trifluoromethyl-benzamide
Method: X-RAY DIFFRACTION / Resolution: 3.24 Å

PDB-3ae7:
Crystal structure of porcine heart mitochondrial complex II bound with 2-Iodo-N-(3-isopropoxy-phenyl)-benzamide
Method: X-RAY DIFFRACTION / Resolution: 3.62 Å

PDB-3ae9:
Crystal structure of porcine heart mitochondrial complex II bound with N-(3-Pentafluorophenyloxy-phenyl)-2-trifluoromethyl-benzamide
Method: X-RAY DIFFRACTION / Resolution: 3.31 Å

PDB-3aea:
Crystal structure of porcine heart mitochondrial complex II bound with N-(3-Dimethylaminomethyl-phenyl)-2-trifluoromethyl-benzamide
Method: X-RAY DIFFRACTION / Resolution: 3.39 Å

PDB-4ysx:
Crystal structure of Mitochondrial rhodoquinol-fumarate reductase from Ascaris suum with the specific inhibitor NN23
Method: X-RAY DIFFRACTION / Resolution: 2.25 Å

PDB-4ysy:
Crystal structure of Mitochondrial rhodoquinol-fumarate reductase from Ascaris suum with N-[(2,4-dichlorophenyl)methyl]-2-(trifluoromethyl)benzamide
Method: X-RAY DIFFRACTION / Resolution: 3.1 Å

PDB-4ysz:
Crystal structure of Mitochondrial rhodoquinol-fumarate reductase from Ascaris suum with 2-iodo-N-[3-(1-methylethoxy)phenyl]benzamide
Method: X-RAY DIFFRACTION / Resolution: 3.3 Å

PDB-4yt0:
Crystal structure of Mitochondrial rhodoquinol-fumarate reductase from Ascaris suum with 2-methyl-N-[3-(1-methylethoxy)phenyl]benzamide.
Method: X-RAY DIFFRACTION / Resolution: 3.66 Å

PDB-4ytm:
Crystal structure of Mitochondrial rhodoquinol-fumarate reductase from Ascaris suum with N-biphenyl-3-yl-2-(trifluoromethyl)benzamide
Method: X-RAY DIFFRACTION / Resolution: 3.4 Å

PDB-4ytp:
CRYSTAL STRUCTURE OF PORCINE HEART MITOCHONDRIAL COMPLEX II BOUND WITH N-[(4-tert-butylphenyl)methyl]-2-(trifluoromethyl)benzamide
Method: X-RAY DIFFRACTION / Resolution: 3.1 Å

PDB-4yxd:
CRYSTAL STRUCTURE OF PORCINE HEART MITOCHONDRIAL COMPLEX II BOUND WITH flutolanil
Method: X-RAY DIFFRACTION / Resolution: 3 Å

PDB-5c2t:
Crystal structure of Mitochondrial rhodoquinol-fumarate reductase from Ascaris suum with rhodoquinone-2
Method: X-RAY DIFFRACTION / Resolution: 2.75 Å

Chemicals

ChemComp-FAD:
FLAVIN-ADENINE DINUCLEOTIDE / FAD*YM

ChemComp-MLI:
MALONATE ION

ChemComp-FES:
FE2/S2 (INORGANIC) CLUSTER

ChemComp-SF4:
IRON/SULFUR CLUSTER

ChemComp-F6A:
N-biphenyl-3-yl-2-(trifluoromethyl)benzamide

ChemComp-F3S:
FE3-S4 CLUSTER

ChemComp-HEM:
PROTOPORPHYRIN IX CONTAINING FE

ChemComp-EPH:
L-ALPHA-PHOSPHATIDYL-BETA-OLEOYL-GAMMA-PALMITOYL-PHOSPHATIDYLETHANOLAMINE / phospholipid*YM

ChemComp-12J:
2-iodo-N-[3-(1-methylethoxy)phenyl]benzamide

ChemComp-FD8:
N-[3-(pentafluorophenoxy)phenyl]-2-(trifluoromethyl)benzamide

ChemComp-F9A:
N-{3-[(dimethylamino)methyl]phenyl}-2-(trifluoromethyl)benzamide

ChemComp-E23:
N-(4-tert-butylbenzyl)-2-(trifluoromethyl)benzamide

ChemComp-HOH:
WATER

ChemComp-E24:
N-(2,4-dichlorobenzyl)-2-(trifluoromethyl)benzamide

ChemComp-MRN:
2-methyl-N-[3-(1-methylethoxy)phenyl]benzamide

ChemComp-FTN:
N-[3-(1-methylethoxy)phenyl]-2-(trifluoromethyl)benzamide

ChemComp-4YP:
2-amino-5-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-3-methoxy-6-methylcyclohexa-2,5-diene-1,4-dione

Source
  • sus scrofa (pig)
  • ascaris suum (pig roundworm)
KeywordsOXIDOREDUCTASE/OXIDOREDUCTASE INHIBITOR / respiratory complex II / inhibitors / Electron transport / Iron-sulfur / Metal-binding / Mitochondrion / Mitochondrion inner membrane / Oxidoreductase / Transit peptide / Transport / Tricarboxylic acid cycle / Heme / Transmembrane / FAD-binding protein / OXIDOREDUCTASE-OXIDOREDUCTASE INHIBITOR complex / Iron / rhodoquinol-fumarate reductase / Complex II / Inhibitor / SUCCINATE DEHYDROGENASE

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