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PDBe Entry: 2cet view

BETA-GLUCOSIDASE FROM THERMOTOGA MARITIMA IN COMPLEX WITH PHENETHYL-SUBSTITUTED GLUCOIMIDAZOLE
Summary
Header HYDROLASEsearch
Method X-RAY DIFFRACTION
Experiment Resolution: 1.97 Å, R-factor: 19.5%, Free R-factor: 24.4%, Spacegroup: P 21 21 21
Released 27/09/2006, deposition: 10/02/2006, last revision: 24/02/2009
Authors Gloster, T.M.search; Roberts, S.search; Vasella, A.search; Davies, G.J.search
Primary citation Structural, Kinetic, and Thermodynamic Analysis of Glucoimidazole-Derived Glycosidase Inhibitors.
BIOCHEMISTRYsearch vol:45, pag:11879 (2006) [PubMed ID 17002288 ]search
Keywords GLYCOSIDE HYDROLASEsearch, INHIBITORsearch, TRANSITION STATE MIMICsearch, FAMILY 1search, PHENETHYL-SUBSTITUTED GLUCOIMIDAZOLEsearch, HYDROLASEsearch
EC 3.2.1.21 ExPASy BRENDA search (A B)
Organism Thermotoga maritima 2336search(A B)
UniProt Beta-glucosidase A (EC 3.2.1.21) (Gentiobiase) (Cellobiase) (Beta-D-glucoside glucohydrolase) Q08638search (A B)
Solvent A, B
Related entries 1od0, 1oif, 1oim, 1oin, 1uz1, 1w3j, 2cbu, 2cbv, 2ces
Polymers
Id Name Type UniProt Residues Observed
A, B BETA-GLUCOSIDASE A Protein Q08638 (BGLA_THEMA)search
468 94%
Heterogens
Id Name Ligands
A ACETATE ION ACT search
A, B (5R,6R,7S,8S)-5-(HYDROXYMETHYL)-2-(2-PHENYLETHYL)-1,5,6,7,8,8A-HEXAHYDROIMIDAZO[1,2-A]PYRIDINE-6,7,8-TRIOL PGI search
B CALCIUM ION CA search
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