7PB7
Structure of LPMO domain of colonization factor GbpA from Vibrio cholerae in the presence of calcium
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM30A |
| Synchrotron site | ESRF |
| Beamline | BM30A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2016-09-16 |
| Detector | MAR CCD 130 mm |
| Wavelength(s) | 0.979655 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 40.610, 45.200, 99.590 |
| Unit cell angles | 90.00, 101.06, 90.00 |
Refinement procedure
| Resolution | 32.580 - 1.800 |
| R-factor | 0.1813 |
| Rwork | 0.179 |
| R-free | 0.22820 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2xwx |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.719 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.13_2998) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 34.270 | 1.900 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Number of reflections | 33236 | 5267 |
| <I/σ(I)> | 7.78 | 1.75 |
| Completeness [%] | 99.5 | 98.5 |
| Redundancy | 4.1 | 4.1 |
| CC(1/2) | 0.993 | 0.705 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.2 M Calcium chloride dihydrate, 0.1 M HEPES pH 7.0, 20 % w/v PEG 6000 |
