5Z7N
SmChiA sliding-intermediate with chitopentaose
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AichiSR BEAMLINE BL2S1 |
Synchrotron site | AichiSR |
Beamline | BL2S1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2017-09-28 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 1.12 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 131.110, 200.360, 59.510 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 44.000 - 1.700 |
Rwork | 0.173 |
R-free | 0.19780 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1eib |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX (1.12) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 44.000 | 1.810 |
High resolution limit [Å] | 1.700 | 1.700 |
Rmerge | 0.098 | 0.731 |
Number of reflections | 164036 | 26031 |
<I/σ(I)> | 12.7 | 2.52 |
Completeness [%] | 98.8 | 96.8 |
Redundancy | 7.7 | 7.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.4 | 294 | 700 mM Sodium citrate, 10% methanol, 5% glycerol |