4PUU

Human Aldose Reductase complexed with a ligand with an IDD structure (2-(2-carbamoyl-5-fluoro-phenoxy)acetic acid) at 1.14 A

Summary for 4PUU

• Entry DOI: 10.2210/pdb4puu/pdb
• Related: 1us0 2ikj 4PUW
• Descriptor: Aldose reductase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, (2-carbamoyl-5-fluorophenoxy)acetic acid, ... (4 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: 36854.91

Authors

Rechlin, C.,Heine, A.,Klebe, G. (deposition date: 2014-03-14, release date: 2015-04-08, Last modification date: 2023-09-20)

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

Experimental method

X-RAY DIFFRACTION (1.14 Å)