4X4D
RADIATION DAMAGE TO THE NUCLEOPROTEIN COMPLEX C.Esp1396I: DOSE (DWD) 10.3 MGy
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-09-29 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.9322 |
Spacegroup name | P 65 |
Unit cell lengths | 104.400, 104.400, 139.160 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 19.038 - 2.800 |
R-factor | 0.2371 |
Rwork | 0.235 |
R-free | 0.28240 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3clc |
RMSD bond length | 0.011 |
RMSD bond angle | 1.338 |
Data reduction software | MOSFLM |
Data scaling software | Aimless (0.2.8) |
Phasing software | PHASER |
Refinement software | PHENIX |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 69.600 | 69.600 | 2.950 |
High resolution limit [Å] | 2.800 | 8.850 | 2.800 |
Rmerge | 0.052 | 0.021 | 0.450 |
Rpim | 0.023 | 0.011 | 0.197 |
Total number of observations | 128743 | 3709 | 19229 |
Number of reflections | 21198 | ||
<I/σ(I)> | 22.4 | 51.4 | 4.2 |
Completeness [%] | 99.9 | 96.2 | 100 |
Redundancy | 6.1 | 5.5 | 6.2 |
CC(1/2) | 0.997 | 0.989 | 0.912 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293.15 | MES, MPD, MgCl2 |