QM/MM Investigation for Protonation States in a Bilin Reductase PcyA-Biliverdin IXɑ Complex

scientific article published on 07 May 2018

QM/MM Investigation for Protonation States in a Bilin Reductase PcyA-Biliverdin IXɑ Complex is …
instance of (P31):
scholarly articleQ13442814

External links are
P356DOI10.1002/CPHC.201800031
P698PubMed publication ID29732737

P50authorMatthew Paul GleesonQ60730551
P2093author name stringMasaki Unno
Seiji Mori
Eri Iijima
P2860cites workFunctional genomic analysis of the HY2 family of ferredoxin-dependent bilin reductases from oxygenic photosynthetic organismsQ24539615
Insight into the radical mechanism of phycocyanobilin-ferredoxin oxidoreductase (PcyA) revealed by X-ray crystallography and biochemical measurementsQ27643744
Structural Basis for Hydration Dynamics in Radical Stabilization of Bilin Reductase MutantsQ27662407
Insights into the Proton Transfer Mechanism of a Bilin Reductase PcyA Following Neutron CrystallographyQ27700201
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Function and distribution of bilin biosynthesis enzymes in photosynthetic organismsQ33375085
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Crystal structure of phycocyanobilin:ferredoxin oxidoreductase in complex with biliverdin IXalpha, a key enzyme in the biosynthesis of phycocyanobilinQ34248245
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Exploring the Limit of Accuracy of the Global Hybrid Meta Density Functional for Main-Group Thermochemistry, Kinetics, and Noncovalent InteractionsQ40260351
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His74 conservation in the bilin reductase PcyA family reflects an important role in protein-substrate structure and dynamicsQ43441898
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Phycocyanobilin:ferredoxin oxidoreductase of Anabaena sp. PCC 7120. Biochemical and spectroscopic.Q44270146
Biliverdin reduction by cyanobacterial phycocyanobilin:ferredoxin oxidoreductase (PcyA) proceeds via linear tetrapyrrole radical intermediatesQ44975938
A conserved histidine-aspartate pair is required for exovinyl reduction of biliverdin by a cyanobacterial phycocyanobilin:ferredoxin oxidoreductase.Q46076632
Efficient synthesis of phycocyanobilin in mammalian cells for optogenetic control of cell signalingQ47594549
Combining Quantum Mechanics Methods with Molecular Mechanics Methods in ONIOM.Q51630551
A Second Generation Force Field for the Simulation of Proteins, Nucleic Acids, and Organic MoleculesQ55918670
First computational step towards the understanding of the antioxidant activity of the Phycocyanobilin:Ferredoxin Oxidoreductase in complex with biliverdin IXαQ56782283
P577publication date2018-05-07
P1433published inChemPhysChemQ2012739
P1476titleQM/MM Investigation for Protonation States in a Bilin Reductase PcyA-Biliverdin IXɑ Complex

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