2BHN
XPF from Aeropyrum pernix
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SRS BEAMLINE PX14.2 |
Synchrotron site | SRS |
Beamline | PX14.2 |
Temperature [K] | 120 |
Detector technology | CCD |
Detector | ADSC CCD |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 210.325, 42.752, 118.736 |
Unit cell angles | 90.00, 121.42, 90.00 |
Refinement procedure
Resolution | 25.000 - 3.200 |
R-factor | 0.221 |
Rwork | 0.216 |
R-free | 0.32000 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | SEPARATE DOMAINS FROM PART-REFINED PDB ENTRY 2BGW |
RMSD bond length | 0.015 |
RMSD bond angle | 1.703 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 38.930 | 3.370 |
High resolution limit [Å] | 3.200 | 3.200 |
Rmerge | 0.060 | 0.310 |
Number of reflections | 52273 | |
<I/σ(I)> | 10.6 | 2.4 |
Completeness [%] | 99.9 | 100 |
Redundancy | 3.6 | 3.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 65% V/V MPD, 0.1M TRIS-HCL PH8.0. SITTING DROPS. |