1KJN
Structure of MT0777
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2001-07-08 |
| Detector | SBC-1 |
| Wavelength(s) | 0.97938, 0.97916, 0.97779 |
| Spacegroup name | P 21 21 2 |
| Unit cell lengths | 75.590, 62.280, 68.840 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 48.070 - 2.200 |
| Rwork | 0.217 |
| R-free | 0.25000 |
| Structure solution method | MAD |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.500 |
| Data reduction software | HKL-2000 |
| Data scaling software | d*TREK |
| Phasing software | SnB |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.070 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.066 | 0.553 |
| Number of reflections | 37502 | |
| <I/σ(I)> | 16 | 1.4 |
| Completeness [%] | 88.4 | 40.3 |
| Redundancy | 4 | 1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 298 | PEG 3350, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 298.0K |
