6V5M
Crystal Structure of Metallo Beta Lactamase from Hirschia baltica in Complex with Succinate
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 | 2017-07-31 |
Detector | DECTRIS PILATUS3 X 6M |
Wavelength(s) | 0.97918 |
Spacegroup name | H 3 2 |
Unit cell lengths | 77.609, 77.609, 241.883 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 40.310 - 1.500 |
R-factor | 0.143 |
Rwork | 0.142 |
R-free | 0.16740 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6v54 |
RMSD bond length | 0.011 |
RMSD bond angle | 1.129 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | HKL-3000 |
Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.530 |
High resolution limit [Å] | 1.500 | 1.500 |
Number of reflections | 45429 | 2116 |
<I/σ(I)> | 31.2 | 1 |
Completeness [%] | 99.7 | 94.1 |
Redundancy | 14.1 | 4.5 |
CC(1/2) | 0.494 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 289 | 1.0 M Succinic acid pH 7.0;0.1 M Bis-Tris Propane pH 7.0 |