3UMJ
Crystal Structure of D311E Lipase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | BRUKER AXS MICROSTAR |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-06-04 |
| Detector | Bruker Platinum 135 |
| Wavelength(s) | 1.540 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 117.323, 81.162, 100.140 |
| Unit cell angles | 90.00, 96.49, 90.00 |
Refinement procedure
| Resolution | 33.170 - 2.100 |
| R-factor | 0.15806 |
| Rwork | 0.155 |
| R-free | 0.21163 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2dsn |
| RMSD bond length | 0.022 |
| RMSD bond angle | 1.786 |
| Data reduction software | XPREP |
| Data scaling software | SADABS |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 37.570 | 2.200 |
| High resolution limit [Å] | 2.100 | 2.100 |
| Rmerge | 0.083 | 0.195 |
| Number of reflections | 88705 | |
| <I/σ(I)> | 4.01 | |
| Completeness [%] | 96.9 | 91.4 |
| Redundancy | 2.93 | 2.15 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 293.15 | 0.1M MES, 0.1M Sodium phosphate, 0.1M Potassium phosphate, 1.5M NaCl, pH 5.5, VAPOR DIFFUSION, SITTING DROP, temperature 293.15K |
