5HWC
Aspergillus fumigatus FKBP12 P90G protein bound with FK506 in P212121 space group
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU FR-E+ SUPERBRIGHT |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2012-10-10 |
Detector | RIGAKU RAXIS IV |
Wavelength(s) | 1.54 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 37.010, 51.138, 55.592 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 37.636 - 2.050 |
R-factor | 0.1706 |
Rwork | 0.165 |
R-free | 0.22600 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.007 |
RMSD bond angle | 1.221 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX |
Refinement software | PHENIX (1.8.1_1168) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 2.090 |
High resolution limit [Å] | 2.050 | 5.560 | 2.050 |
Rmerge | 0.057 | 0.050 | 0.095 |
Number of reflections | 6350 | ||
<I/σ(I)> | 34.1 | ||
Completeness [%] | 90.3 | 99.5 | 99.1 |
Redundancy | 5.2 | 4.7 | 5.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 298 | 0.8M Sodium Phosphate,1.2M Potassium Phosphate, 0.1M Acetate pH 4.5 |