5V1U
TbiB1 in Complex with the TbiA(beta) Leader Peptide
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-G |
Synchrotron site | APS |
Beamline | 21-ID-G |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2016-10-08 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 0.978560 |
Spacegroup name | P 1 |
Unit cell lengths | 43.155, 48.630, 55.287 |
Unit cell angles | 78.30, 66.88, 88.12 |
Refinement procedure
Resolution | 31.257 - 2.052 |
R-factor | 0.2025 |
Rwork | 0.201 |
R-free | 0.23990 |
RMSD bond length | 0.004 |
RMSD bond angle | 0.853 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | PHASER |
Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.090 |
High resolution limit [Å] | 2.050 | 2.050 |
Number of reflections | 23055 | 1003 |
<I/σ(I)> | 17.6 | 2.9 |
Completeness [%] | 91.2 | 82.6 |
Redundancy | 2.7 | 2.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 292 | 4% isopropanol, 0.05 M zinc acetate, 0.1 M sodium cacodylate (pH 6.5), 6 mg/mL Protein, 1 mM TbiA(beta) T(-5)E |