6QRI
Structure of rabbit G-actin in complex with chivosazole A
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-2 |
| Synchrotron site | ESRF |
| Beamline | ID23-2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-12-08 |
| Detector | DECTRIS PILATUS3 2M |
| Wavelength(s) | 0.873 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 72.540, 78.619, 77.055 |
| Unit cell angles | 90.00, 115.11, 90.00 |
Refinement procedure
| Resolution | 49.160 - 2.400 |
| R-factor | 0.238 |
| Rwork | 0.236 |
| R-free | 0.26830 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1yxq |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.947 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.200 | 2.490 |
| High resolution limit [Å] | 2.400 | 2.400 |
| Number of reflections | 30437 | 2925 |
| <I/σ(I)> | 7 | 0.98 |
| Completeness [%] | 98.8 | 95.6 |
| Redundancy | 3.6 | 3.5 |
| CC(1/2) | 0.990 | 0.470 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.5 M lithium chloride, 100 mM Tris(hydroxymethyl)aminomethane hydrochloride (Tris-HCl), 28 % (w/v) polyethylenglycol 6000, pH 8.5 |
