3QJC
Human Hemoglobin A Mutant Beta H63L Carbonmonoxy-Form
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RUH3R |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2009-03-09 |
Detector | RIGAKU RAXIS IV++ |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 53.300, 53.300, 192.700 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 51.371 - 2.001 |
R-factor | 0.1992 |
Rwork | 0.194 |
R-free | 0.25020 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 2dn3 |
RMSD bond length | 0.028 |
RMSD bond angle | 0.994 |
Data reduction software | d*TREK |
Data scaling software | d*TREK |
Phasing software | PHENIX |
Refinement software | PHENIX ((phenix.refine: 1.6.4_486)) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 51.371 | 51.340 | 2.070 |
High resolution limit [Å] | 2.000 | 4.310 | 2.000 |
Number of reflections | 18799 | ||
<I/σ(I)> | 7.7 | 4.3 | |
Completeness [%] | 95.4 | 84.2 | 97.4 |
Redundancy | 4 | 4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | SMALL TUBES | 6.7 | 293 | 2.3 M Na/K phosphate, pH 6.7, SMALL TUBES, temperature 293K |