6XNU
CRYSTAL STRUCTURE OF CBPB PROTEIN (LMO1009) FROM LISTERIA MONOCYTOGENES
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 5.0.1 |
Synchrotron site | ALS |
Beamline | 5.0.1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2015-09-06 |
Detector | MAR CCD 165 mm |
Wavelength(s) | 1.000 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 54.260, 71.972, 74.648 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 43.330 - 1.620 |
R-factor | 0.2015 |
Rwork | 0.200 |
R-free | 0.22100 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3lqn |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX |
Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 1.680 |
High resolution limit [Å] | 1.620 | 3.490 | 1.620 |
Rmerge | 0.046 | 0.035 | 0.391 |
Rmeas | 0.052 | 0.039 | 0.444 |
Rpim | 0.022 | 0.017 | 0.205 |
Total number of observations | 200768 | ||
Number of reflections | 37711 | 3988 | 3418 |
<I/σ(I)> | 16.4 | ||
Completeness [%] | 98.9 | 98.2 | 90.8 |
Redundancy | 5.3 | 5.2 | 4.3 |
CC(1/2) | 0.998 | 0.910 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | EVAPORATION | 6.1 | 298 | 0.1 M MES (pH 6.1), and 17% MPD |