Brand  (β version)

PDB ID: 1PWM

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Ligands
Code Name Style Show Link
CL Chloride ion PoSSuM
FID (2s,4s)-2-aminoformyl-6-fluoro-spiro[chroman-4,4'-imidazolidine]-2',5'-dione PoSSuM
NAP Nadp nicotinamide-adenine-dinucleotide phosphate PoSSuM
Non-standard Residues
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Glycosylation
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Structure summary

Code : 1PWM   PDBj   RCSB PDB   PDBe
Header : OXIDOREDUCTASE
Title : Crystal structure of human Aldose Reductase complexed with NADP and Fidarestat
Release Data : 2004-02-24
Compound :
mol_id molecule chains
1 aldose reductase A
ec: 1.1.1.21
Source :
mol_id organism_scientific organism_common expression_system
1 Homo sapiens  (taxid:9606) Human Escherichia coli BL21  (taxid:511693)
expression_system_strain: BL21
expression_system_vector_type: plasmid
expression_system_plasmid: pET15b
Authors : El-Kabbani, O., Darmanin, C., Schneider, T.R., Hazemann, I., Ruiz, F., Oka, M., Joachimiak, A., Schulze-Briese, C., Tomizaki, T., Mitschler, A., Podjarny, A.
Keywords : ALDOSE REDUCTASE, ATOMIC RESOLUTION, TERNARY COMPLEX, INHIBITOR BINDING, OXIDOREDUCTASE
Exp. method : X-RAY DIFFRACTION ( 0.92 Å )
Citation :

Ultrahigh resolution drug design. II. Atomic resolution structures of human aldose reductase holoenzyme complexed with Fidarestat and Minalrestat: implications for the binding of cyclic imide inhibitors

El-Kabbani, O.,Darmanin, C.,Schneider, T.R.  et al.
(2004)  PROTEINS  55 : 805 - 813

PubMed: 15146479
DOI: 10.1002/prot.20001

Reaction

Chain : A
UniProt : P15121 (ALDR_HUMAN)
Reaction: EC: Evidence:
Physiological Direction:
an alditol + NADP(+) = an aldose + NADPH + H(+) 1.1.1.21 PubMed:8245005
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all-trans-retinol + NADP(+) = all-trans-retinal + NADPH + H(+) 1.1.1.300 PubMed:12732097, PubMed:21329680
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9-cis-retinol + NADP(+) = 9-cis-retinal + NADPH + H(+) - PubMed:12732097, PubMed:21329680
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13-cis-retinol + NADP(+) = 13-cis-retinal + NADPH + H(+) - PubMed:12732097
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glycerol + NADP(+) = D-glyceraldehyde + NADPH + H(+) 1.1.1.372 PubMed:10510318, PubMed:12732097, PubMed:1936586, PubMed:21329680, PubMed:8245005
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glycerol + NADP(+) = L-glyceraldehyde + NADPH + H(+) 1.1.1.372 PubMed:10510318, PubMed:12732097, PubMed:1936586, PubMed:21329680, PubMed:8245005
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prenol + NADP(+) = 3-methyl-2-butenal + NADPH + H(+) - PubMed:21329684
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(E)-hex-2-en-1-ol + NADP(+) = (E)-hex-2-enal + NADPH + H(+) - PubMed:21329684
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(E,E)-2,4-hexadien-1-ol + NADP(+) = (E,E)-2,4-hexadienal + NADPH + H(+) - PubMed:21329684
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a 4-hydroxynonen-1-ol + NADP(+) = a 4-hydroxynonenal + NADPH + H(+) - PubMed:21329684
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prostaglandin F2alpha + NADP(+) = prostaglandin H2 + NADPH + H(+) - PubMed:19010934
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allyl alcohol + NADP(+) = acrolein + NADPH + H(+) 1.1.1.54 PubMed:10510318, PubMed:21329684
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pyridine 3-methanol + NADP(+) = pyridine-3-carbaldehyde + NADPH + H(+) - PubMed:12732097
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1-hexadecanoyl-2-(5-oxopentanoyl)-sn-glycero-3-phosphocholine + NADPH + H(+) = 1-hexadecanoyl-2-(5-hydroxypentanoyl)-sn-glycero-3- phosphocholine + NADP(+) - PubMed:17381426
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1-hexadecanoyl-2-(7-oxoheptanoyl)-sn-glycero-3-phosphocholine + NADPH + H(+) = 1-hexadecanoyl-2-(7-hydroxyheptanoyl)-sn-glycero-3- phosphocholine + NADP(+) - PubMed:17381426
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1-hexadecanoyl-2-(9-oxononanoyl)-sn-glycero-3-phosphocholine + NADPH + H(+) = 1-hexadecanoyl-2-(9-hydroxynonanoyl)-sn-glycero-3- phosphocholine + NADP(+) - PubMed:17381426
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1-hexadecanoyl-2-(5-oxopentanoyl)-sn-glycero-3- phosphoethanolamine + NADPH + H(+) = 1-hexadecanoyl-2-(5- hydroxypentanoyl)-sn-glycero-3-phosphoethanolamine + NADP(+) - PubMed:17381426
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