1UWS
Structure of beta-glycosidase from Sulfolobus solfataricus in complex with 2-deoxy-2-fluoro-glucose
- PDB DOI: https://doi.org/10.2210/pdb1UWS/pdb
- Classification: HYDROLASE
- Organism(s): Saccharolobus solfataricus
- Expression System: Escherichia coli BL21
- Mutation(s): No
- Deposited: 2004-02-11 Released: 2004-05-20
Experimental Data Snapshot
- Method: X-RAY DIFFRACTION
- Resolution: 1.95 Å
- R-Value Free: 0.229
- R-Value Work: 0.192
- R-Value Observed: 0.193
This is version 1.4 of the entry. See complete history.
Macromolecules
Find similar proteins by:
(by identity cutoff) | 3D Structure
Entity ID: 1 | |||||
|---|---|---|---|---|---|
| Molecule | Chains | Sequence Length | Organism | Details | Image |
| BETA-GALACTOSIDASE | 489 | Saccharolobus solfataricus | Mutation(s): 0 EC: 3.2.1.23 |  | |
UniProt | |||||
Find proteins for P22498 (Saccharolobus solfataricus (strain ATCC 35092 / DSM 1617 / JCM 11322 / P2)) Explore P22498 Go to UniProtKB: P22498 | |||||
Entity Groups | |||||
| Sequence Clusters | 30% Identity50% Identity70% Identity90% Identity95% Identity100% Identity | ||||
| UniProt Group | P22498 | ||||
Sequence AnnotationsExpand | |||||
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Small Molecules
| Ligands 2 Unique | |||||
|---|---|---|---|---|---|
| ID | Chains | Name / Formula / InChI Key | 2D Diagram | 3D Interactions | |
| G2F Query on G2F | C [auth A], E [auth B] | 2-deoxy-2-fluoro-alpha-D-glucopyranose C6 H11 F O5 ZCXUVYAZINUVJD-UKFBFLRUSA-N |  | ||
| ACT Query on ACT | D [auth A] | ACETATE ION C2 H3 O2 QTBSBXVTEAMEQO-UHFFFAOYSA-M |  | ||
Experimental Data & Validation
Experimental Data
- Method: X-RAY DIFFRACTION
- Resolution: 1.95 Å
- R-Value Free: 0.229
- R-Value Work: 0.192
- R-Value Observed: 0.193
- Space Group: P 31 2 1
Unit Cell:
| Length ( Å ) | Angle ( ˚ ) |
|---|---|
| a = 167.605 | α = 90 |
| b = 167.605 | β = 90 |
| c = 95.448 | γ = 120 |
| Software Name | Purpose |
|---|---|
| REFMAC | refinement |
| DENZO | data reduction |
| SCALEPACK | data scaling |
| AMoRE | phasing |
Entry History
Deposition Data
- Released Date: 2004-05-20 Deposition Author(s): Gloster, T.M., Roberts, S., Ducros, V.M.-A., Perugino, G., Rossi, M., Hoos, R., Moracci, M., Vasella, A., Davies, G.J.
Revision History (Full details and data files)
- Version 1.0: 2004-05-20
Type: Initial release - Version 1.1: 2015-04-15
Changes: Database references, Derived calculations, Structure summary, Version format compliance - Version 1.2: 2018-02-28
Changes: Database references, Source and taxonomy - Version 1.3: 2020-07-29
Type: Remediation
Reason: Carbohydrate remediation
Changes: Data collection, Derived calculations, Other - Version 1.4: 2023-12-13
Changes: Data collection, Database references, Refinement description, Structure summary
