3ZGY
Apo-structure of R-selective imine reductase from Streptomyces kanamyceticus
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 120 |
| Detector technology | CCD |
| Collection date | 2012-07-07 |
| Detector | ADSC CCD |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 203.410, 131.110, 77.480 |
| Unit cell angles | 90.00, 107.22, 90.00 |
Refinement procedure
| Resolution | 36.230 - 2.710 |
| R-factor | 0.18695 |
| Rwork | 0.185 |
| R-free | 0.21379 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1yb4 |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.636 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | BALBES |
| Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 108.680 | 2.790 |
| High resolution limit [Å] | 2.710 | 2.710 |
| Rmerge | 0.050 | 0.520 |
| Number of reflections | 49759 | |
| <I/σ(I)> | 13.9 | 2.3 |
| Completeness [%] | 99.3 | 99.6 |
| Redundancy | 3.4 | 3.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7 | PROTEIN AT 10 MG ML-1. 35% (V/V) TASCIMATE PH 7.0 WITH 2.5% (V/V) ETHYLENE GLYCOL. |
