2X3K
CO-COMPLEX STRUCTURE OF ACHROMOBACTIN SYNTHETASE PROTEIN D (ACSD) WITH AMP AND SULFATE FROM PECTOBACTERIUM CHRYSANTHEMI
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-2 |
| Synchrotron site | ESRF |
| Beamline | ID14-2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-09-01 |
| Detector | ADSC CCD |
| Spacegroup name | P 1 |
| Unit cell lengths | 57.700, 70.000, 96.000 |
| Unit cell angles | 95.00, 101.90, 94.70 |
Refinement procedure
| Resolution | 39.660 - 2.500 |
| R-factor | 0.208 |
| Rwork | 0.205 |
| R-free | 0.26076 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3ffe |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.563 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.5.0070) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 39.700 | 2.600 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.080 | 0.300 |
| Number of reflections | 46179 | |
| <I/σ(I)> | 5.6 | 1.7 |
| Completeness [%] | 96.6 | 94.6 |
| Redundancy | 2.6 | 2.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 0.1 M SODIUM CACODYLATE PH 6.5, 29 % (W/V) PEG 8000 AND 200 MM (NH4)2SO4 AND 10 MM AMP |
