4B2I
Humanised monomeric RadA in complex with indazole
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-4 |
| Synchrotron site | ESRF |
| Beamline | ID14-4 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-10-04 |
| Detector | ADSC QUANTUM 210 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 37.620, 78.770, 39.630 |
| Unit cell angles | 90.00, 118.06, 90.00 |
Refinement procedure
| Resolution | 33.064 - 1.300 |
| R-factor | 0.2005 |
| Rwork | 0.199 |
| R-free | 0.22320 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1PZN CHAIN A |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.549 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | AMoRE |
| Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 39.380 | 1.380 |
| High resolution limit [Å] | 1.300 | 1.300 |
| Rmerge | 0.040 | 0.490 |
| Number of reflections | 49540 | |
| <I/σ(I)> | 18.2 | 2.6 |
| Completeness [%] | 99.0 | 99 |
| Redundancy | 3.6 | 3.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 6.2 | 10-15% PEG-1000, 50 MM NAKPHOSPHATE, PH 6.2 |
