7ZO6
L1 metallo-beta-lactamase in complex with hydrolysed cefoxitin
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-05-12 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.97628 |
Spacegroup name | P 64 2 2 |
Unit cell lengths | 105.345, 105.345, 97.891 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 45.620 - 1.610 |
R-factor | 0.1653 |
Rwork | 0.164 |
R-free | 0.18800 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 7o0o |
Data reduction software | DIALS |
Data scaling software | DIALS |
Phasing software | PHASER |
Refinement software | PHENIX (1.18.2_3874) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 66.740 | 1.640 |
High resolution limit [Å] | 1.610 | 1.610 |
Rpim | 0.016 | 1.058 |
Number of reflections | 42005 | 2063 |
<I/σ(I)> | 21.3 | 0.4 |
Completeness [%] | 100.0 | 99.9 |
Redundancy | 18.9 | |
CC(1/2) | 1.000 | 0.566 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 277 | 100 mM Hepes pH 7.75, 2.0 M ammonium sulphate, 1.5% PEG400. 1 ul protein (15 mg/ml) mixed with 1 ul reservoir. |