6U2Y
Crystal Structure of the metallo-beta-lactamase L1 from Stenotrophomonas maltophilia in the complex with the hydrolyzed moxalactam and two Ni ions
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-ID |
Synchrotron site | APS |
Beamline | 19-ID |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-04-19 |
Detector | DECTRIS PILATUS3 X 6M |
Wavelength(s) | 0.97918 |
Spacegroup name | P 64 2 2 |
Unit cell lengths | 104.132, 104.132, 98.927 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 46.070 - 1.500 |
R-factor | 0.1451 |
Rwork | 0.144 |
R-free | 0.16770 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | PDBID 6U0Y |
RMSD bond length | 0.009 |
RMSD bond angle | 1.037 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | HKL-3000 |
Refinement software | PHENIX |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.530 |
High resolution limit [Å] | 1.500 | 1.500 |
Rmerge | 0.116 | 0.792 |
Number of reflections | 50905 | 2426 |
<I/σ(I)> | 22.76 | 1.21 |
Completeness [%] | 99.7 | 96.8 |
Redundancy | 10 | |
CC(1/2) | 0.701 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 289 | 0.2 M Sodium malonate pH 7.0, 20% w/v Polyethylene glycol 3,350 |