4Q8I
Crystal Structure of beta-lactamase from M.tuberculosis covalently complexed with Tebipenem
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU |
Detector technology | IMAGE PLATE |
Detector | RIGAKU RAXIS IV++ |
Wavelength(s) | 1.5418 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 49.925, 68.026, 75.554 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 91.359 - 1.901 |
R-factor | 0.1673 |
Rwork | 0.161 |
R-free | 0.22510 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4hfx |
RMSD bond length | 0.006 |
RMSD bond angle | 1.210 |
Data scaling software | HKL-3000 |
Phasing software | PHENIX |
Refinement software | PHENIX ((phenix.refine: 1.8.1_1168)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 41.650 | 41.650 |
High resolution limit [Å] | 1.900 | 1.900 |
Number of reflections | 20453 | |
Completeness [%] | 97.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 283 | 0.1M HEPES, pH 7.5, 2M NH4H2PO4 Protein concentration 12 mgs/ml, VAPOR DIFFUSION, HANGING DROP, temperature 283K |