1YQO
T268A mutant heme domain of flavocytochrome P450 BM3
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SRS BEAMLINE PX14.1 |
Synchrotron site | SRS |
Beamline | PX14.1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2003-05-20 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.9831 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 58.727, 152.962, 61.732 |
Unit cell angles | 90.00, 94.37, 90.00 |
Refinement procedure
Resolution | 24.000 - 1.900 |
R-factor | 0.16842 |
Rwork | 0.166 |
R-free | 0.20635 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | PDB ID 2HPD |
RMSD bond length | 0.020 |
RMSD bond angle | 1.696 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | REFMAC (5.2.0003) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 24.000 | 1.970 |
High resolution limit [Å] | 1.900 | 1.900 |
Rmerge | 0.043 | 0.144 |
Number of reflections | 84625 | |
<I/σ(I)> | 33.4 | 7.95 |
Completeness [%] | 99.4 | 94.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6 | 277 | 100mM sodium PIPES, 40mM MgSO4, 18-21% PEG8000, pH 6.0-7.5, VAPOR DIFFUSION, HANGING DROP, temperature 277K |