Structures of lanosterol 14-alpha demethylase mutants.
Sagatova, A., Keniya, M.V., Wilson, R.K., Sabherwal, M., Tyndall, J.D.A., Monk, B.C.To be published.
Experimental Data Snapshot
Starting Model: experimental
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Entity ID: 1 | |||||
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Molecule | Chains | Sequence Length | Organism | Details | Image |
Lanosterol 14-alpha demethylase | 539 | Saccharomyces cerevisiae YJM789 | Mutation(s): 1 Gene Names: ERG11, SCY_2394 Membrane Entity: Yes | ||
UniProt | |||||
Find proteins for A6ZSR0 (Saccharomyces cerevisiae (strain YJM789)) Explore A6ZSR0 Go to UniProtKB: A6ZSR0 | |||||
Entity Groups | |||||
Sequence Clusters | 30% Identity50% Identity70% Identity90% Identity95% Identity100% Identity | ||||
UniProt Group | A6ZSR0 | ||||
Sequence AnnotationsExpand | |||||
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Ligands 2 Unique | |||||
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ID | Chains | Name / Formula / InChI Key | 2D Diagram | 3D Interactions | |
1YN Query on 1YN | B [auth A] | 2-[(2R)-butan-2-yl]-4-{4-[4-(4-{[(2R,4S)-2-(2,4-dichlorophenyl)-2-(1H-1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy}phenyl)piperazin-1-yl]phenyl}-2,4-dihydro-3H-1,2,4-triazol-3-one C35 H38 Cl2 N8 O4 VHVPQPYKVGDNFY-DFMJLFEVSA-N | |||
HEM Query on HEM | C [auth A] | PROTOPORPHYRIN IX CONTAINING FE C34 H32 Fe N4 O4 KABFMIBPWCXCRK-RGGAHWMASA-L |
Length ( Å ) | Angle ( ˚ ) |
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a = 77.09 | α = 90 |
b = 65.39 | β = 98.42 |
c = 80.78 | γ = 90 |
Software Name | Purpose |
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PHENIX | refinement |
Blu-Ice | data collection |
Aimless | data scaling |
PHENIX | phasing |
Funding Organization | Location | Grant Number |
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Health Research Council (HRC) | New Zealand | -- |
Marsden Fund | New Zealand | -- |