7SML
Crystal Structure of L-GALACTONO-1,4-LACTONE DEHYDROGENASE de Myrciaria dubia
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | LNLS SIRUS BEAMLINE MANACA |
| Synchrotron site | LNLS SIRUS |
| Beamline | MANACA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-10-03 |
| Detector | DECTRIS PILATUS 2M |
| Wavelength(s) | 1.323630 |
| Spacegroup name | P 21 2 21 |
| Unit cell lengths | 64.157, 79.089, 89.939 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 43.580 - 2.100 |
| R-factor | 0.208 |
| Rwork | 0.206 |
| R-free | 0.24300 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | ALPHAFOLD |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.7.4) |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.18.2_3874) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 44.970 | 2.160 |
| High resolution limit [Å] | 2.100 | 2.100 |
| Rmerge | 0.225 | 2.469 |
| Number of reflections | 27421 | |
| <I/σ(I)> | 7.9 | |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 13.3 | 13.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.1 M SPG (succinic acid, sodium dihydrogen phosphate, and glycine in the molar ratios 2:7:7); pH 7.0 and 25 % w/v PEG 1500 |
