3H4I
Chimeric Glycosyltransferase for the generation of novel natural products
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM16 |
| Synchrotron site | ESRF |
| Beamline | BM16 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-12-05 |
| Detector | MAR CCD 130 mm |
| Wavelength(s) | 0.98 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 111.480, 129.830, 67.440 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 29.250 - 1.300 |
| R-factor | 0.16481 |
| Rwork | 0.164 |
| R-free | 0.18383 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1pn3 |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.222 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | AMoRE |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 29.920 | 1.370 |
| High resolution limit [Å] | 1.300 | 1.300 |
| Rmerge | 0.074 | 0.569 |
| Total number of observations | 838486 | |
| Number of reflections | 119259 | |
| Completeness [%] | 99.9 | 100 |
| Redundancy | 7 | 7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 300 | 0.1M Tris-HCL, 1.2-2M ammonium sulphate, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 300K |
