4CB7
Structure of Influenza A H5N1 PB2 cap-binding domain with bound cap analogue (compound 8e)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-4 |
Synchrotron site | ESRF |
Beamline | ID14-4 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-08-30 |
Detector | ADSC QUANTUM 315r |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 36.940, 108.180, 39.050 |
Unit cell angles | 90.00, 91.08, 90.00 |
Refinement procedure
Resolution | 36.960 - 1.850 |
R-factor | 0.17336 |
Rwork | 0.171 |
R-free | 0.21410 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2vqz |
RMSD bond length | 0.013 |
RMSD bond angle | 1.630 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.940 |
High resolution limit [Å] | 1.850 | 1.850 |
Rmerge | 0.070 | 0.430 |
Number of reflections | 25819 | |
<I/σ(I)> | 12.3 | 2.8 |
Completeness [%] | 98.9 | 99.7 |
Redundancy | 3.29 | 2.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6.3 | 0.2M AMMONIUM NITRATE, PH 6.3, 20 % PEG 3350 |