7PJJ
Structure of the Family-3 Glycosyl Hydrolase BcpE2 from Streptomyces scabies
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SOLEIL BEAMLINE PROXIMA 2 |
| Synchrotron site | SOLEIL |
| Beamline | PROXIMA 2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-04-15 |
| Detector | DECTRIS EIGER X 9M |
| Wavelength(s) | 0.98010 |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 109.620, 109.620, 164.180 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 47.410 - 3.086 |
| R-factor | 0.2252 |
| Rwork | 0.223 |
| R-free | 0.27020 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4i3g |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.000 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | BUSTER (2.10.4) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.500 | 3.270 |
| High resolution limit [Å] | 3.086 | 3.086 |
| Rmerge | 0.273 | 2.220 |
| Number of reflections | 21414 | 3286 |
| <I/σ(I)> | 6.9 | 0.9 |
| Completeness [%] | 99.3 | 96.6 |
| Redundancy | 6.7 | 6.4 |
| CC(1/2) | 0.991 | 0.301 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293 | methylpentane-2,4-dio (MDP) 45%, 0.1M TrisHCl pH 8.5, 0.2M ammonium acetate |
