3NE9
Chronobacterium ammoiniagenes apo-ACPS structure
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 14-ID-B |
| Synchrotron site | APS |
| Beamline | 14-ID-B |
| Temperature [K] | 120 |
| Detector technology | CCD |
| Collection date | 1999-06-10 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 0.9792, 0.97906, 0.96380 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 51.399, 59.002, 153.561 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 30.000 - 2.500 |
| R-factor | 0.20811 |
| Rwork | 0.205 |
| R-free | 0.26820 |
| Structure solution method | MAD |
| RMSD bond length | 0.031 |
| RMSD bond angle | 2.570 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | SOLVE |
| Refinement software | REFMAC (5.1.24) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 2.500 |
| High resolution limit [Å] | 2.480 | 2.480 |
| Rmerge | 0.050 | |
| Number of reflections | 16681 | |
| <I/σ(I)> | 17.35 | 4.6 |
| Completeness [%] | 94.7 | 75.9 |
| Redundancy | 0.76 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | EVAPORATION | 6.5 | 100 mM MES buffer pH 6.5, 0.2 M ammonium sulfate, 30% PEG MME 5K, EVAPORATION |
