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PDBe Entry: 2j7c view

BETA-GLUCOSIDASE FROM THERMOTOGA MARITIMA IN COMPLEX WITH PHENYLAMINOMETHYL-DERIVED GLUCOIMIDAZOLE
Summary
Header HYDROLASEsearch
Method X-RAY DIFFRACTION
Experiment Resolution: 2.09 Å, R-factor: 19.5%, Free R-factor: 25.4%, Spacegroup: P 21 21 21
Released 17/10/2006, deposition: 06/10/2006, last revision: 24/02/2009
Authors Gloster, T.M.search; Zechel, D.search; Vasella, A.search; Davies, G.J.search
Primary citation Glycosidase Inhibition: An Assessment of the Binding of 18 Putative Transition-State Mimics.
J.AM.CHEM.SOC.search vol:129, pag:2345 (2007) [PubMed ID 17279749 ]search
Keywords FAMILY 1search, HYDROLASEsearch, INHIBITORsearch, GLYCOSIDASEsearch, POLYSACCHARIDE DEGRADATIONsearch, TRANSITION STATE MIMICsearch, CARBOHYDRATE METABOLISMsearch, GLYCOSIDE HYDROLASEsearch, CELLULOSE DEGRADATIONsearch
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, 1oin, 1uz1, 1w3j, 2cbu, 2cbv, 2ces, 2cet, 2j75, 2j77, 2j78, 2j79, 2j7a, 2j7b, 2j7d, 2j7e, 2j7f, 2j7g, 2j7h
Polymers
Id Name Type UniProt Residues Observed
A, B BETA-GLUCOSIDASE A Protein Q08638 (BGLA_THEMA)search
468 94%
Heterogens
Id Name Ligands
A, B (5R,6R,7S,8S)-3-(ANILINOMETHYL)-5,6,7,8-TETRAHYDRO-5-(HYDROXYMETHYL)-IMIDAZO[1,2-A]PYRIDINE-6,7,8-TRIOL IDE search
A ACETATE ION ACT search
B CALCIUM ION CA search
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