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Structure paper

Title1-Deoxynojirimycin-6-phosphate is a tool to explore selectivity of inhibitors against phosphoglucose isomerase in Aspergillus fumigatus
Journal, issue, pagesTo Be Published
Publish dateMay 5, 2025 (structure data deposition date)
AuthorsYan, K. / Borodkin, V. / Fang, W. / van Aalten, D.
External linksSearch PubMed
MethodsX-ray diffraction
Resolution1.5 - 2.12 Å
Structure data

PDB-9r3n:
The structure of Aspergillus fumigatus phosphoglucose isomerase in complex with fragments
Method: X-RAY DIFFRACTION / Resolution: 1.83 Å

PDB-9r3q:
The structure of Aspergillus fumigatus phosphoglucose isomerase in complex with an inhibitor
Method: X-RAY DIFFRACTION / Resolution: 2.12 Å

PDB-9r5h:
The structure of CaPGI in complex with fragments
Method: X-RAY DIFFRACTION / Resolution: 1.5 Å

PDB-9r5j:
The structure of CaPGI in complex with fragments
Method: X-RAY DIFFRACTION / Resolution: 1.5 Å

PDB-9r5u:
The structure of CaPGI in complex with fragments
Method: X-RAY DIFFRACTION / Resolution: 1.7 Å

Chemicals

ChemComp-XKD:
N-methyl-D-alaninamide

ChemComp-GOL:
GLYCEROL

ChemComp-PA5:
5-PHOSPHOARABINONIC ACID

ChemComp-CL:
Unknown entry

ChemComp-NA:
Unknown entry

ChemComp-HOH:
WATER


PDB Unreleased entry

PDB-1jcw: Unknown entry

PDB-1jcv:
REDUCED BRIDGE-BROKEN YEAST CU/ZN SUPEROXIDE DISMUTASE LOW TEMPERATURE (-180C) STRUCTURE

ChemComp-XH1:
N-propan-2-ylurea

Source
  • aspergillus fumigatus (mold)
  • candida albicans (yeast)
KeywordsISOMERASE / PGI / fragment / inhibitor / Aspergillus / Candida

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