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Structure paper

TitleInhibitors targeted to aldehyde dehydrogenase
Journal, issue, pagesNat. Chem. Biol., Year 2022
Publish dateApr 20, 2021 (structure data deposition date)
AuthorsFernandez, D.
External linksSearch PubMed
MethodsX-ray diffraction
Resolution2.12 - 2.68 Å
Structure data

PDB-7mjc:
Crystal Structure Analysis of ALDH1B1
Method: X-RAY DIFFRACTION / Resolution: 2.68 Å

PDB-7mjd:
Crystal Structure Analysis of ALDH1B1
Method: X-RAY DIFFRACTION / Resolution: 2.12 Å

PDB-7rad:
Crystal Structure Analysis of ALDH1B1
Method: X-RAY DIFFRACTION / Resolution: 2.3 Å

Chemicals

ChemComp-NAD:
NICOTINAMIDE-ADENINE-DINUCLEOTIDE / NAD*YM

ChemComp-NA:
Unknown entry

ChemComp-HOH:
WATER

ChemComp-ZGG:
8-(2-methoxyphenyl)-10-(4-phenylphenyl)-1$l^{4},8-diazabicyclo[5.3.0]deca-1(7),9-diene

ChemComp-1PE:
PENTAETHYLENE GLYCOL / precipitant*YM

ChemComp-GOL:
GLYCEROL

ChemComp-ZGJ:
3-(2-methoxyphenyl)-1-(4-phenylphenyl)-6,7,8,9-tetrahydro-5~{H}-imidazo[1,2-a][1,3]diazepine

ChemComp-EDO:
1,2-ETHANEDIOL

Source
  • homo sapiens (human)
KeywordsOXIDOREDUCTASE / mitochondrial metabolism / pancreas cancer / colorectal cancer

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