The Multifunctional Globin Dehaloperoxidase as a Biocatalyst in the Oxidation of Monoterpenes
Malewschick, T., Yun, D., de Serrano, V., Ghiladi, R.A.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 |
Dehaloperoxidase B | 137 | Amphitrite ornata | Mutation(s): 0  | ||
UniProt | |||||
Find proteins for Q9NAV7 (Amphitrite ornata) Explore Q9NAV7  Go to UniProtKB:  Q9NAV7 | |||||
Entity Groups   | |||||
Sequence Clusters | 30% Identity50% Identity70% Identity90% Identity95% Identity100% Identity | ||||
UniProt Group | Q9NAV7 | ||||
Sequence AnnotationsExpand | |||||
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Ligands 4 Unique | |||||
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ID | Chains | Name / Formula / InChI Key | 2D Diagram | 3D Interactions | |
HEM (Subject of Investigation/LOI) Query on HEM | C [auth A], K [auth B] | PROTOPORPHYRIN IX CONTAINING FE C34 H32 Fe N4 O4 KABFMIBPWCXCRK-RGGAHWMASA-L | |||
9IU (Subject of Investigation/LOI) Query on 9IU | D [auth A], L [auth B] | (4S)-1-methyl-4-(prop-1-en-2-yl)cyclohex-1-ene C10 H16 XMGQYMWWDOXHJM-SNVBAGLBSA-N | |||
SO4 (Subject of Investigation/LOI) Query on SO4 | I [auth A], J [auth A] | SULFATE ION O4 S QAOWNCQODCNURD-UHFFFAOYSA-L | |||
GOL (Subject of Investigation/LOI) Query on GOL | E [auth A] F [auth A] G [auth A] H [auth A] M [auth B] | GLYCEROL C3 H8 O3 PEDCQBHIVMGVHV-UHFFFAOYSA-N |
Length ( Å ) | Angle ( ˚ ) |
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a = 59.839 | α = 90 |
b = 67.375 | β = 90 |
c = 67.857 | γ = 90 |
Software Name | Purpose |
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REFMAC | refinement |
HKL-2000 | data reduction |
SCALEPACK | data scaling |
PHASER | phasing |
Funding Organization | Location | Grant Number |
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National Science Foundation (NSF, United States) | United States | -- |