3EHM
Structure of BT1043
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-BM |
| Synchrotron site | APS |
| Beamline | 19-BM |
| Temperature [K] | 150 |
| Detector technology | CCD |
| Collection date | 2006-11-30 |
| Detector | SBC-3 |
| Wavelength(s) | 0.97934, 0.97951, 0.97167 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 60.283, 102.230, 175.750 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 50.000 - 2.000 |
| Rwork | 0.171 |
| R-free | 0.20700 |
| RMSD bond length | 0.005 |
| RMSD bond angle | 1.256 |
| Data reduction software | HKL-3000 |
| Data scaling software | SCALEPACK |
| Phasing software | SOLVE |
| Refinement software | CNS |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.010 |
| High resolution limit [Å] | 1.940 | 1.940 |
| Number of reflections | 78668 | |
| <I/σ(I)> | 32.2 | 8.5 |
| Completeness [%] | 96.9 | |
| Redundancy | 4.1 | 3.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 9 | 277 | 6-7% polyethylene glycol 6000, 50 mM NaCl, 50mM 2-(cyclohexylamino)-ethanesulfonic acid (CHES), pH 9.0, batch/microseeding, temperature 277K |
