4IMR
Crystal structure of 3-oxoacyl (acyl-carrier-protein) reductase (target EFI-506442) from agrobacterium tumefaciens C58 with NADP bound
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 31-ID |
| Synchrotron site | APS |
| Beamline | 31-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-11-11 |
| Detector | RAYONIX MX225HE |
| Spacegroup name | P 61 2 2 |
| Unit cell lengths | 87.919, 87.919, 308.309 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 34.160 - 1.960 |
| R-factor | 0.1819 |
| Rwork | 0.181 |
| R-free | 0.21908 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4g81 |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.419 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.980 |
| High resolution limit [Å] | 1.950 | 1.950 |
| Rmerge | 0.650 | |
| Number of reflections | 46926 | |
| <I/σ(I)> | 6.9 | 4 |
| Completeness [%] | 89.4 | 100 |
| Redundancy | 20.4 | 21.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 6.5 | 0.1M SODIUM CACODYLATE, PH 6.5, 1M SODIUM CITRATE TRIBASIC, VAPOR DIFFUSION, SITTING DROP, TEMPERATURE 294K |
