3GKV
X-ray structure of an intermediate along the oxidation pathway of Trematomus bernacchii hemoglobin
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-1 |
| Synchrotron site | ESRF |
| Beamline | ID14-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2000-03-19 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 1.00 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 86.880, 87.647, 55.339 |
| Unit cell angles | 90.00, 100.17, 90.00 |
Refinement procedure
| Resolution | 28.250 - 1.400 |
| R-factor | 0.184 |
| Rwork | 0.184 |
| R-free | 0.21100 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2peg |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | AMoRE |
| Refinement software | X-PLOR (3.851) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 30.000 |
| High resolution limit [Å] | 1.400 |
| Rmerge | 0.038 |
| Number of reflections | 80090 |
| Completeness [%] | 99.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | LIQUID DIFFUSION | 7.6 | 298 | protein concentration of 6mg/ml, 14% Mpeg 5000 in 50mM Tris/HCl buffer ph 7.6, LIQUID DIFFUSION, temperature 298K |
