4X9T
Crystal structure of a TctC solute binding protein from Polaromonas (Bpro_3516, Target EFI-510338), no ligand
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 31-ID |
Synchrotron site | APS |
Beamline | 31-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2014-11-12 |
Detector | RAYONIX MX-225 |
Wavelength(s) | 0.97931 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 31.976, 79.244, 111.583 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 22.810 - 1.240 |
R-factor | 0.1647 |
Rwork | 0.163 |
R-free | 0.18970 |
Structure solution method | SAD |
RMSD bond length | 0.005 |
RMSD bond angle | 1.027 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX |
Refinement software | PHENIX |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 100.000 | 100.000 | 1.260 |
High resolution limit [Å] | 1.240 | 3.370 | 1.240 |
Rmerge | 0.081 | 0.046 | 0.871 |
Total number of observations | 500010 | ||
Number of reflections | 71858 | ||
<I/σ(I)> | 9.2 | ||
Completeness [%] | 88.1 | 98.3 | 89.1 |
Redundancy | 7 | 9.7 | 6.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 298 | Protein (77.6 mg/ml, 10 mM HEPES pH 7.5, 5 mM DTT), Reservoir (MCSG 1, H10, 0.1 M HEPES pH 7.5, 25 %(w/v) PEG 3350), Cryoprotection (Reservoir,dehydrated) |