7E7U
Crystal structure of RSL mutant in complex with sugar Ligand
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17U1 |
Synchrotron site | SSRF |
Beamline | BL17U1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2020-06-21 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.97918 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 47.802, 79.470, 152.466 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 35.260 - 2.100 |
R-factor | 0.1997 |
Rwork | 0.197 |
R-free | 0.26210 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4csd |
RMSD bond length | 0.013 |
RMSD bond angle | 1.977 |
Data reduction software | autoPROC |
Data scaling software | Aimless (0.7.4) |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 35.260 | 35.240 | 2.110 |
High resolution limit [Å] | 2.010 | 6.340 | 2.010 |
Rmerge | 0.136 | 0.046 | 1.316 |
Rmeas | 0.142 | 0.049 | 1.371 |
Rpim | 0.039 | 0.015 | 0.377 |
Total number of observations | 15343 | 42350 | |
Number of reflections | 37046 | 1402 | 3325 |
<I/σ(I)> | 14 | 35.3 | 2.2 |
Completeness [%] | 92.9 | 99 | 58.5 |
Redundancy | 13 | 10.9 | 12.7 |
CC(1/2) | 0.999 | 0.999 | 0.861 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | SMALL TUBES | 7.5 | 277 | 20 mM Tris-HCl, 100 mM of NaCl; pH 7.5, Micro centrifuge tube sequentially put with RSL solution, pure buffer, and the ligand solution |