4QBX

Human Aldose Reductase complexed with a ligand with an IDD structure ({5-fluoro-2-[(3-nitrobenzyl)carbamoyl]phenoxy}acetic acid) at 0.98 A

Summary for 4QBX

• Entry DOI: 10.2210/pdb4qbx/pdb
• Related: 1US0 4PUU 4PUW 4Q7B
• Descriptor: Aldose reductase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, {5-fluoro-2-[(3-nitrobenzyl)carbamoyl]phenoxy}acetic acid, ... (5 entities in total)
• Functional Keywords: tim barrel, oxidoreductase, oxidoreductase-oxidoreductase inhibitor complex, oxidoreductase/oxidoreductase inhibitor
• Biological source: Homo sapiens (human)
• Cellular location: Cytoplasm: P15121
• Total number of polymer chains: 1
• Total formula weight: 37182.15

Authors

Rechlin, C.,Heine, A.,Klebe, G. (deposition date: 2014-05-09, release date: 2015-07-22, Last modification date: 2023-09-20)

• Primary citation: Rechlin, C.,Scheer, F.,Toth, P.,Heine, A.,Diederich, W.,Klebe, G.; Aldose Reductase: How expensive is the opening of the specificity pocket? IDD ligands under investigation; To be Published,

Experimental method

X-RAY DIFFRACTION (0.98 Å)