3KZL
Crystal structure of BA2930 mutant (H183G) in complex with AcCoA
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-BM |
| Synchrotron site | APS |
| Beamline | 19-BM |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-10-16 |
| Detector | ADSC QUANTUM 210r |
| Wavelength(s) | 0.9792 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 71.831, 109.182, 73.721 |
| Unit cell angles | 90.00, 111.91, 90.00 |
Refinement procedure
| Resolution | 34.570 - 2.100 |
| R-factor | 0.18255 |
| Rwork | 0.180 |
| R-free | 0.23181 |
| Structure solution method | SAD |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.516 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | HKL-3000 |
| Refinement software | REFMAC (5.5.0072) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.140 |
| High resolution limit [Å] | 2.100 | 2.100 |
| Rmerge | 0.117 | 0.571 |
| Number of reflections | 61626 | |
| <I/σ(I)> | 16.7 | 1.8 |
| Completeness [%] | 98.9 | 87.8 |
| Redundancy | 4 | 2.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | 0.1 M Hepes, pH 7.5, 0.2 M MgCl2, 15% PEG 3350, 1% CHAPSO, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
