4O7L
SAICAR synthetase (Type-2) in complex with ADP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | BRUKER AXS MICROSTAR |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2011-09-26 |
| Detector | MAR scanner 345 mm plate |
| Wavelength(s) | 1.5418 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 44.040, 153.780, 78.240 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 54.840 - 2.100 |
| R-factor | 0.2034 |
| Rwork | 0.201 |
| R-free | 0.24394 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3u55 |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.459 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA (3.3.20) |
| Phasing software | PHASER (2.3.0) |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 54.840 | 2.200 |
| High resolution limit [Å] | 2.090 | 2.090 |
| Rmerge | 0.095 | 0.497 |
| Number of reflections | 15680 | |
| <I/σ(I)> | 12.4 | 3.4 |
| Completeness [%] | 96.4 | 81.6 |
| Redundancy | 6.1 | 5.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Microbatch Underoil | 4.6 | 293 | 0.2M Ammonium Sulphate, 0.1M Sodium acetate trihydrate, 30% w/v PEG monomethyl ether 2000, pH 4.6, Microbatch Underoil, temperature 293K |
