4BT7
acetolactate decarboxylase with a bound phosphate ion
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 | 2011-09-17 |
| Detector | ADSC CCD |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 47.010, 47.010, 198.970 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 31.510 - 1.100 |
| R-factor | 0.1648 |
| Rwork | 0.164 |
| R-free | 0.17966 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4bt2 |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.612 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 32.000 | 1.160 |
| High resolution limit [Å] | 1.100 | 1.100 |
| Rmerge | 0.070 | 0.340 |
| Number of reflections | 104587 | |
| <I/σ(I)> | 11 | 3.3 |
| Completeness [%] | 99.6 | 99.8 |
| Redundancy | 6.2 | 6.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 8.5 | 0.2 M TRIMETHYLAMINE N-OXIDE (TMAO), 0.1 M TRIS PH 8.5, 28-33 PEG 2K MME |
