1YJQ
Crystal structure of ketopantoate reductase in complex with NADP+
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SRS BEAMLINE PX14.2 |
| Synchrotron site | SRS |
| Beamline | PX14.2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2004-05-21 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 60.833, 66.138, 98.808 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 28.000 - 2.090 |
| R-factor | 0.16173 |
| Rwork | 0.160 |
| R-free | 0.19368 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1ks9 |
| RMSD bond length | 0.024 |
| RMSD bond angle | 1.903 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | AMoRE |
| Refinement software | REFMAC (5.1.24) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 55.050 | 2.150 |
| High resolution limit [Å] | 2.090 | 2.100 |
| Rmerge | 0.092 | 0.436 |
| Number of reflections | 24200 | |
| <I/σ(I)> | 14 | 3.2 |
| Completeness [%] | 99.7 | 99.9 |
| Redundancy | 26.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5 | 290 | 10% MPD, 0.1M Sodium Acetate, 2mM NADP+, 2mM ketopantoate, pH 5.0, VAPOR DIFFUSION, HANGING DROP, temperature 290K |
