2RD9
Crystal structure of a putative yfit-like metal-dependent hydrolase (bh0186) from bacillus halodurans c-125 at 2.30 A resolution
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL11-1 |
| Synchrotron site | SSRL |
| Beamline | BL11-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-07-20 |
| Detector | MARMOSAIC 325 mm CCD |
| Wavelength(s) | 0.91837, 0.97941 |
| Spacegroup name | P 21 3 |
| Unit cell lengths | 147.330, 147.330, 147.330 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 29.463 - 2.300 |
| R-factor | 0.155 |
| Rwork | 0.152 |
| R-free | 0.20100 |
| Structure solution method | MAD |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.425 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | SHELX |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 29.463 | 29.463 | 2.380 |
| High resolution limit [Å] | 2.300 | 4.930 | 2.300 |
| Rmerge | 0.066 | 0.022 | 0.336 |
| Number of reflections | 47316 | 9196 | 8684 |
| <I/σ(I)> | 14.51 | 38.6 | 3.1 |
| Completeness [%] | 99.5 | 98.5 | 97.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 277 | NANODROP, 10.0% PEG 6000, 0.1M HEPES pH 7.0, VAPOR DIFFUSION, SITTING DROP, temperature 277K |
