3AQ5
Crystal structure of truncated hemoglobin from Tetrahymena pyriformis, Fe(II)-O2 form
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE BL-5A |
Synchrotron site | Photon Factory |
Beamline | BL-5A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-10-13 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 1.0000 |
Spacegroup name | P 65 2 2 |
Unit cell lengths | 69.355, 69.355, 353.761 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 33.270 - 1.780 |
R-factor | 0.18775 |
Rwork | 0.187 |
R-free | 0.20927 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1dlw |
RMSD bond length | 0.032 |
RMSD bond angle | 2.528 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 33.270 | 1.810 |
High resolution limit [Å] | 1.780 | 1.780 |
Number of reflections | 48931 | |
<I/σ(I)> | 4.5 | |
Completeness [%] | 98.3 | 92.7 |
Redundancy | 7.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 293 | 2.0M ammonium citrate, pH 7.0, VAPOR DIFFUSION, SITTING DROP, temperature 293K |