Download MendeleyStructural characterisation of staphylococcus aureus biotin protein ligase
Pendini, N.R., Yap, M.Y., Polyak, S.W., Cowieson, N., Traore, D.A.K., Booker, G.W., Wallace, J.C., Abell, A., Wilce, J.A., Wilce, M.C.J.To be published.
3RKW
Structural characterisation of staphylococcus aureus biotin protein ligase
- PDB DOI: https://doi.org/10.2210/pdb3RKW/pdb
- Classification: LIGASE
- Organism(s): Staphylococcus aureus subsp. aureus ECT-R 2
- Expression System: Escherichia coli
- Mutation(s): No
- Deposited: 2011-04-18 Released: 2012-04-18
Experimental Data Snapshot
- Method: X-RAY DIFFRACTION
- Resolution: 2.50 Å
- R-Value Free: 0.263
- R-Value Work: 0.213
- R-Value Observed: 0.215
Starting Model: experimental
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This is version 1.1 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 |
| Biotin-[acetyl-CoA-carboxylase] ligase | 323 | Staphylococcus aureus subsp. aureus ECT-R 2 | Mutation(s): 0 Gene Names: ECTR2_1310 EC: 6.3.4.15 |  | |
Entity Groups | |||||
| Sequence Clusters | 30% Identity50% Identity70% Identity90% Identity95% Identity100% Identity | ||||
Sequence AnnotationsExpand | |||||
| |||||
Small Molecules
| Ligands 1 Unique | |||||
|---|---|---|---|---|---|
| ID | Chains | Name / Formula / InChI Key | 2D Diagram | 3D Interactions | |
| BT5 Query on BT5 | B [auth A] | BIOTINYL-5-AMP C20 H28 N7 O9 P S UTQCSTJVMLODHM-RHCAYAJFSA-N |  | ||
Experimental Data & Validation
Experimental Data
- Method: X-RAY DIFFRACTION
- Resolution: 2.50 Å
- R-Value Free: 0.263
- R-Value Work: 0.213
- R-Value Observed: 0.215
- Space Group: P 42 21 2
Unit Cell:
| Length ( Å ) | Angle ( ˚ ) |
|---|---|
| a = 94.598 | α = 90 |
| b = 94.598 | β = 90 |
| c = 130.626 | γ = 90 |
| Software Name | Purpose |
|---|---|
| Blu-Ice | data collection |
| PHENIX | refinement |
| MOSFLM | data reduction |
| SCALA | data scaling |
Entry History
Deposition Data
- Released Date: 2012-04-18 Deposition Author(s): Wilce, M.C.J., Pendini, N.R., Yap, M.Y.
Revision History (Full details and data files)
- Version 1.0: 2012-04-18
Type: Initial release - Version 1.1: 2023-11-01
Changes: Data collection, Database references, Derived calculations, Refinement description
