5YAL
Ferulic acid esterase from Streptomyces cinnamoneus at 1.5 A resolution
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 | 2014-05-11 |
| Detector | BRUKER SMART 6500 |
| Wavelength(s) | 0.9 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 52.900, 70.850, 87.170 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 42.390 - 1.500 |
| R-factor | 0.18096 |
| Rwork | 0.180 |
| R-free | 0.20094 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5yae |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.180 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0123) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 42.400 | 1.540 |
| High resolution limit [Å] | 1.500 | 1.500 |
| Rmerge | 0.053 | 0.604 |
| Number of reflections | 53162 | |
| <I/σ(I)> | 14.7 | 2.3 |
| Completeness [%] | 99.9 | 99.8 |
| Redundancy | 3.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | PEG 8000, sodium acetate trihydrate, sodium cacodylate trihydrate |
