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Structure paper

TitleCrystal structures of human glyoxalase I and its complex with TLSC702 reveal inhibitor binding mode and substrate preference.
Journal, issue, pagesFebs Lett., Vol. 596, Page 1458-1467, Year 2022
Publish dateFeb 3, 2022 (structure data deposition date)
AuthorsUsami, M. / Ando, K. / Shibuya, A. / Takasawa, R. / Yokoyama, H.
External linksFebs Lett. / PubMed:35363883
MethodsX-ray diffraction
Resolution1.52 - 2 Å
Structure data

PDB-7wsz:
human glyoxalase I (with C-ter His tag) in glycerol-bound form
Method: X-RAY DIFFRACTION / Resolution: 1.52 Å

PDB-7wt0:
human glyoxalase I (with C-ter His tag) in complex with TLSC702
Method: X-RAY DIFFRACTION / Resolution: 2 Å

PDB-7wt1:
human glyoxalase I (with C-ter His tag) in inhibitor-free form
Method: X-RAY DIFFRACTION / Resolution: 1.85 Å

PDB-7wt2:
human glyoxalase I in complex with TLSC702
Method: X-RAY DIFFRACTION / Resolution: 2 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-GOL:
GLYCEROL

ChemComp-BO3:
BORIC ACID

ChemComp-IMD:
IMIDAZOLE

ChemComp-BME:
BETA-MERCAPTOETHANOL

ChemComp-HOH:
WATER

ChemComp-5ZO:
(~{E})-3-(1,3-benzothiazol-2-yl)-4-(4-methoxyphenyl)but-3-enoic acid

Source
  • homo sapiens (human)
KeywordsLYASE / glyoxalase I / zinc metalloenzyme

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