Brand  (β version)

PDB ID: 3FX4

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Ligands
Code Name Style Show Link
FX4 [(5z)-5-{[3-(carboxymethoxy)-4-methoxyphenyl]methylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]acetic acid PoSSuM
NAP Nadp nicotinamide-adenine-dinucleotide phosphate PoSSuM
SO4 Sulfate ion PoSSuM
Non-standard Residues
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Structure summary

Code : 3FX4   PDBj   RCSB PDB   PDBe
Header : OXIDOREDUCTASE
Title : Porcine aldehyde reductase in ternary complex with inhibitor
Release Data : 2009-12-22
Compound :
mol_id molecule chains synonym
1 Alcohol dehydrogenase [NADP+] A Aldehyde reductase, Aldo-keto reductase family 1 member A1
ec: 1.1.1.2
Source :
mol_id organism_scientific organism_common
1 Sus scrofa  (taxid:9823) Pig
tissue: kidney
Authors : Carbone, V., El-Kabbani, O.
Keywords : TIM BARREL, ALDO-KETO REDUCTASE, TERNARY COMPLEX, Acetylation, NADP, Oxidoreductase
Exp. method : X-RAY DIFFRACTION ( 1.99 Å )
Citation :

Structure of aldehyde reductase in ternary complex with a 5-arylidene-2,4-thiazolidinedione aldose reductase inhibitor.

Carbone, V.,Giglio, M.,Chung, R.  et al.
(2010)  Eur.J.Med.Chem.  45 : 1140 - 1145

PubMed: 20036445
DOI: 10.1016/j.ejmech.2009.12.019

Reaction

Chain : A
UniProt : P50578 (AK1A1_PIG)
Reaction: EC: Evidence:
Physiological Direction:
a primary alcohol + NADP(+) = an aldehyde + H(+) + NADPH 1.1.1.2 PubMed:12732097
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glycerol + NADP(+) = D-glyceraldehyde + H(+) + NADPH 1.1.1.372 PubMed:12732097
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glycerol + NADP(+) = H(+) + L-glyceraldehyde + NADPH 1.1.1.372 PubMed:12732097
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L-gulonate + NADP(+) = aldehydo-D-glucuronate + H(+) + NADPH 1.1.1.19 UniProtKB:P51635
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L-gulono-1,4-lactone + NADP(+) = D-glucurono-3,6-lactone + H(+) + NADPH 1.1.1.20 UniProtKB:P51635
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allyl alcohol + NADP(+) = acrolein + H(+) + NADPH 1.1.1.54 UniProtKB:P51635
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hydroxyacetone + NADP(+) = H(+) + methylglyoxal + NADPH - UniProtKB:P51635
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3-deoxyfructose + NADP(+) = 3-deoxyglucosone + H(+) + NADPH - UniProtKB:P51635
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(R)-mevalonate + NADP(+) = (R)-mevaldate + H(+) + NADPH - UniProtKB:P51635
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NADP(+) + pyridine 3-methanol = H(+) + NADPH + pyridine-3- carbaldehyde - PubMed:12732097
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