3E0A
Thaumatin by Classical hanging drop method after high X-Ray dose on ESRF ID29 beamline
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-04-29 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.9787 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 57.926, 57.926, 150.687 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 54.070 - 1.510 |
| R-factor | 0.155 |
| Rwork | 0.154 |
| R-free | 0.18100 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1rqw |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.076 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA (3.2.25) |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 54.074 | 1.590 |
| High resolution limit [Å] | 1.510 | 1.510 |
| Rmerge | 0.053 | 0.225 |
| Total number of observations | 1832 | |
| Number of reflections | 32305 | |
| <I/σ(I)> | 3.2 | |
| Completeness [%] | 78.2 | 24.4 |
| Redundancy | 5.7 | 1.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 100mM ADA, 1M Na/K-tartrate, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
