1TU9
Crystal Structure of a Protein PA3967, a Structurally Highly Homologous to a Human Hemoglobin, from Pseudomonas aeruginosa PAO1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-ID |
Synchrotron site | APS |
Beamline | 19-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2004-06-14 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.9794 |
Spacegroup name | P 61 2 2 |
Unit cell lengths | 52.557, 52.557, 182.628 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 45.640 - 1.200 |
R-factor | 0.164 |
Rwork | 0.161 |
R-free | 0.19057 |
Structure solution method | MAD |
RMSD bond length | 0.012 |
RMSD bond angle | 1.481 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | SHELXD |
Refinement software | REFMAC (5.2) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 45.640 | 1.240 |
High resolution limit [Å] | 1.200 | 1.200 |
Rmerge | 0.042 | 0.458 |
Number of reflections | 45270 | |
<I/σ(I)> | 10.2 | 1.7 |
Completeness [%] | 94.4 | 75.6 |
Redundancy | 10.4 | 3.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 298 | PEG3350, sodium acetate, VAPOR DIFFUSION, HANGING DROP, temperature 298K | |
1 | VAPOR DIFFUSION, HANGING DROP | 298 | PEG3350, sodium acetate, VAPOR DIFFUSION, HANGING DROP, temperature 298K | |
1 | VAPOR DIFFUSION, HANGING DROP | 298 | PEG3350, sodium acetate, VAPOR DIFFUSION, HANGING DROP, temperature 298K |