Iterative Use of Regiocomplementary Flavin-Dependent Halogenases Gives Access to Unique Halogenation Patterns
Montua, N., Scharkowski, B., Bork, S., Niemann, H.H., Sewald, N.(2025) Adv Synth Catal 
Experimental Data Snapshot
Starting Model: experimental
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(2025) Adv Synth Catal 
Entity ID: 1 | |||||
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Molecule | Chains | Sequence Length | Organism | Details | Image |
Tryptophan 6-halogenase | 534 | Streptomyces albogriseolus | Mutation(s): 0  Gene Names: thal, thdH EC: 1.14.19.59 | ![]() | |
UniProt | |||||
Find proteins for A1E280 (Streptomyces albogriseolus) Explore A1E280  Go to UniProtKB:  A1E280 | |||||
Entity Groups   | |||||
Sequence Clusters | 30% Identity50% Identity70% Identity90% Identity95% Identity100% Identity | ||||
UniProt Group | A1E280 | ||||
Sequence AnnotationsExpand | |||||
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Ligands 3 Unique | |||||
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ID | Chains | Name / Formula / InChI Key | 2D Diagram | 3D Interactions | |
BTR (Subject of Investigation/LOI) Query on BTR | C [auth A], F [auth A], H [auth B], K [auth B], L [auth B] | 6-BROMO-TRYPTOPHAN C11 H11 Br N2 O2 OAORYCZPERQARS-VIFPVBQESA-N | |||
PO4 Query on PO4 | D [auth A], G [auth A], I [auth B], J [auth B], M [auth B] | PHOSPHATE ION O4 P NBIIXXVUZAFLBC-UHFFFAOYSA-K | |||
GOL Query on GOL | E [auth A] | GLYCEROL C3 H8 O3 PEDCQBHIVMGVHV-UHFFFAOYSA-N |
Length ( Å ) | Angle ( ˚ ) |
---|---|
a = 136.748 | α = 90 |
b = 136.748 | β = 90 |
c = 144.358 | γ = 120 |
Software Name | Purpose |
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PHENIX | refinement |
XDS | data reduction |
STARANISO | data scaling |
PHENIX | phasing |
Funding Organization | Location | Grant Number |
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German Research Foundation (DFG) | Germany | NI 694/10-1 |