5AH0
STRUCTURE OF LIPASE 1 FROM PELOSINUS FERMENTANS
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-2 |
| Synchrotron site | ESRF |
| Beamline | ID23-2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-03-10 |
| Detector | MARMOSAIC 225 mm CCD |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 91.800, 91.800, 215.900 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 48.202 - 2.500 |
| R-factor | 0.196 |
| Rwork | 0.194 |
| R-free | 0.24280 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1ku0 |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.995 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 60.000 | 2.640 |
| High resolution limit [Å] | 2.490 | 2.490 |
| Rmerge | 0.100 | 0.740 |
| Number of reflections | 33116 | |
| <I/σ(I)> | 17.1 | 3.5 |
| Completeness [%] | 99.3 | 96.3 |
| Redundancy | 12.7 | 12.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 0.8 M POTASSIUM SODIUM TARTRATE TETRAHYDRATE, 0.1 M TRIS, PH 8.5 AND 0.5 % W/V POLYETHYLENE GLYCOL MONOMETHYL ETHER 5000 |
