3H7U
Crystal structure of the plant stress-response enzyme AKR4C9
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 | 2002-07-11 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 0.933 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 79.355, 70.687, 65.767 |
| Unit cell angles | 90.00, 107.22, 90.00 |
Refinement procedure
| Resolution | 23.480 - 1.250 |
| R-factor | 0.13245 |
| Rwork | 0.131 |
| R-free | 0.15619 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1s1p |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.457 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | AMoRE |
| Refinement software | REFMAC (5.5.0044) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 23.480 |
| High resolution limit [Å] | 1.250 |
| Number of reflections | 87990 |
| <I/σ(I)> | 16.1 |
| Completeness [%] | 92.0 |
| Redundancy | 3.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 6 | 291 | 400 mM Ammonium acetate, 100 mM Tri-sodium citrate dihydrate, 37.5% w/v PEG 4000, pH 6.0, VAPOR DIFFUSION, temperature 291K |
