4N9L
crystal structure of beta-lactamse PenP_E166S in complex with meropenem
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 HF |
Temperature [K] | 291 |
Detector technology | IMAGE PLATE |
Collection date | 2013-07-05 |
Detector | RIGAKU RAXIS IV++ |
Wavelength(s) | 1.5418 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 43.260, 90.960, 66.200 |
Unit cell angles | 90.00, 104.24, 90.00 |
Refinement procedure
Resolution | 37.100 - 2.300 |
R-factor | 0.18354 |
Rwork | 0.180 |
R-free | 0.24187 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.015 |
RMSD bond angle | 1.996 |
Data reduction software | d*TREK |
Data scaling software | d*TREK |
Phasing software | PHASES |
Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 45.480 |
High resolution limit [Å] | 2.300 |
Number of reflections | 22119 |
Completeness [%] | 99.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 289 | Tris, PEG 3350, ammonium acetate, pH 8.0, vapor diffusion, hanging drop, temperature 289K |