2HTD
CRYSTAL STRUCTURE OF A PUTATIVE PYRIDOXAMINE 5'-PHOSPHATE OXIDASE (LDB0262) FROM LACTOBACILLUS DELBRUECKII SUBSP. AT 1.60 A RESOLUTION
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL9-2 |
| Synchrotron site | SSRL |
| Beamline | BL9-2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-07-02 |
| Detector | MARMOSAIC 325 mm CCD |
| Wavelength(s) | 0.91837,0.97929,0.97911 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 34.104, 71.123, 47.031 |
| Unit cell angles | 90.00, 90.86, 90.00 |
Refinement procedure
| Resolution | 39.253 - 1.600 |
| R-factor | 0.16 |
| Rwork | 0.158 |
| R-free | 0.20600 |
| Structure solution method | MAD |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.566 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | SHELX |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 39.253 | 47.040 | 1.680 |
| High resolution limit [Å] | 1.595 | 5.040 | 1.600 |
| Rmerge | 0.107 | 0.059 | 0.987 |
| Total number of observations | 5291 | 14774 | |
| Number of reflections | 29681 | ||
| <I/σ(I)> | 4.8 | 10.8 | 0.7 |
| Completeness [%] | 99.9 | 99 | 99.8 |
| Redundancy | 5.2 | 5.4 | 3.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 4 | 277 | 2.4M (NH4)2SO4, 0.1M Citrate pH 4.0, VAPOR DIFFUSION, SITTING DROP, NANODROP, temperature 277K |
