Download MendeleyCrystal Structure of Class a Beta-Lactamase from Bacillus Licheniformis Inhibited by Tazobactam
Power, P., Herman, R., Kerff, F., Mercuri, P., Galleni, M., Gutkind, G., Charlier, P., Sauvage, E.To be published.
4A5R | pdb_00004a5r
Crystal structure of class A beta-lactamase from Bacillus licheniformis BS3 with tazobactam
- PDB DOI: https://doi.org/10.2210/pdb4A5R/pdb
- Classification: HYDROLASE
- Organism(s): Bacillus licheniformis
- Mutation(s): No
- Deposited: 2011-10-28 Released: 2012-10-10
Experimental Data Snapshot
- Method: X-RAY DIFFRACTION
- Resolution: 2.10 Å
- R-Value Free: 0.233 (Depositor), 0.240 (DCC)
- R-Value Work: 0.182 (Depositor), 0.180 (DCC)
- R-Value Observed: 0.185 (Depositor)
Starting Model: experimental
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This is version 1.2 of the entry. See complete history.
Literature
To be published.
Macromolecules
Find similar proteins by:
(by identity cutoff) | 3D Structure
Entity ID: 1 | |||||
|---|---|---|---|---|---|
| Molecule | Chains | Sequence Length | Organism | Details | Image |
| BETA-LACTAMASE | 265 | Bacillus licheniformis | Mutation(s): 0 EC: 3.5.2.6 |  | |
UniProt | |||||
Find proteins for P94458 (Bacillus licheniformis) Explore P94458 Go to UniProtKB: P94458 | |||||
Entity Groups | |||||
| Sequence Clusters | 30% Identity50% Identity70% Identity90% Identity95% Identity100% Identity | ||||
| UniProt Group | P94458 | ||||
Sequence AnnotationsExpand | |||||
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Small Molecules
| Ligands 4 Unique | |||||
|---|---|---|---|---|---|
| ID | Chains | Name / Formula / InChI Key | 2D Diagram | 3D Interactions | |
| TBE Query on TBE | C [auth A], G [auth B] | TAZOBACTAM INTERMEDIATE C10 H14 N4 O5 S ANZZKUOZZHRUQC-AARLMMRRSA-N |  | ||
| CIT Query on CIT | D [auth A] | CITRIC ACID C6 H8 O7 KRKNYBCHXYNGOX-UHFFFAOYSA-N |  | ||
| PGE Query on PGE | E [auth A] | TRIETHYLENE GLYCOL C6 H14 O4 ZIBGPFATKBEMQZ-UHFFFAOYSA-N |  | ||
| CO2 Query on CO2 | F [auth B], H [auth B] | CARBON DIOXIDE C O2 CURLTUGMZLYLDI-UHFFFAOYSA-N |  | ||
Experimental Data & Validation
Experimental Data
- Method: X-RAY DIFFRACTION
- Resolution: 2.10 Å
- R-Value Free: 0.233 (Depositor), 0.240 (DCC)
- R-Value Work: 0.182 (Depositor), 0.180 (DCC)
- R-Value Observed: 0.185 (Depositor)
Space Group: P 1 21 1
Unit Cell:
| Length ( Å ) | Angle ( ˚ ) |
|---|---|
| a = 46.955 | α = 90 |
| b = 103.55 | β = 94.77 |
| c = 63.732 | γ = 90 |
| Software Name | Purpose |
|---|---|
| REFMAC | refinement |
| MOSFLM | data reduction |
| SCALA | data scaling |
Entry History
Deposition Data
- Released Date: 2012-10-10 Deposition Author(s): Power, P., Sauvage, E., Herman, R., Kerff, F., Charlier, P.
Revision History (Full details and data files)
- Version 1.0: 2012-10-10
Type: Initial release - Version 1.1: 2023-12-20
Changes: Data collection, Database references, Derived calculations, Other, Refinement description - Version 1.2: 2024-10-09
Changes: Structure summary
