3ZOH
Crystal structure of FMN-binding protein (YP_005476) from Thermus thermophilus with bound 1-Cyclohex-2-enone
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM14 |
| Synchrotron site | ESRF |
| Beamline | BM14 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-12-01 |
| Detector | MARMOSAIC 225 mm CCD |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 63.771, 73.791, 77.374 |
| Unit cell angles | 90.00, 90.07, 90.00 |
Refinement procedure
| Resolution | 29.530 - 1.650 |
| R-factor | 0.16236 |
| Rwork | 0.161 |
| R-free | 0.18599 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1usc |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.242 |
| Data reduction software | XDS |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 1.750 |
| High resolution limit [Å] | 1.650 | 1.650 |
| Rmerge | 0.050 | 0.640 |
| Number of reflections | 86300 | |
| <I/σ(I)> | 16.5 | 2.3 |
| Completeness [%] | 99.4 | 97 |
| Redundancy | 4.2 | 3.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 12.5% PEG 1000, 12.5% W/V PEG 3350, 12.5% V/V MPD AND 0.1 M ACETATE BUFFER PH 4.5 |
