2YMB
Structures of MITD1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04 |
| Synchrotron site | Diamond |
| Beamline | I04 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-10-11 |
| Detector | ADSC QUANTUM 315r |
| Spacegroup name | I 2 3 |
| Unit cell lengths | 222.046, 222.046, 222.046 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 59.344 - 3.404 |
| R-factor | 0.2301 |
| Rwork | 0.230 |
| R-free | 0.25610 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | PDB ENTRIES 4A5Z AND 4A5X |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.515 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 60.000 | 3.590 |
| High resolution limit [Å] | 3.400 | 3.400 |
| Rmerge | 0.210 | 0.840 |
| Number of reflections | 25007 | |
| <I/σ(I)> | 8.3 | 1.9 |
| Completeness [%] | 99.7 | 98.2 |
| Redundancy | 4.9 | 4.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 8 | 8.8% PEG 20000, 8.8% PEG 550 MME, 0.25 M MGCL2 AND 0.1 M TRIS ACETATE PH 8.0 |
