3A6Z
Crystal structure of Pseudomonas sp. MIS38 lipase (PML) in the open conformation following dialysis against Ca-free buffer
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL44XU |
| Synchrotron site | SPring-8 |
| Beamline | BL44XU |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-02-27 |
| Detector | Bruker DIP-6040 |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 65 2 2 |
| Unit cell lengths | 104.382, 104.382, 495.175 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 48.110 - 2.150 |
| R-factor | 0.18431 |
| Rwork | 0.182 |
| R-free | 0.21965 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2zvd |
| RMSD bond length | 0.019 |
| RMSD bond angle | 1.724 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.230 |
| High resolution limit [Å] | 2.150 | 2.150 |
| Rmerge | 0.136 | 0.437 |
| Number of reflections | 87709 | |
| <I/σ(I)> | 13.76 | 3.1 |
| Completeness [%] | 99.3 | 99.2 |
| Redundancy | 6.9 | 5.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 277 | 0.1M Tris-HCl, pH8.5, 0.2M ammonium acetate, 30% 2-propanol, VAPOR DIFFUSION, HANGING DROP, temperature 277K |
