4ACZ
Structure of the GH99 endo-alpha-mannosidase from Bacteroides thetaiotaomicron
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 | 2010-04-17 |
| Detector | MARRESEARCH |
| Spacegroup name | P 1 |
| Unit cell lengths | 50.748, 62.689, 71.600 |
| Unit cell angles | 103.49, 104.06, 93.21 |
Refinement procedure
| Resolution | 45.660 - 1.990 |
| R-factor | 0.18567 |
| Rwork | 0.184 |
| R-free | 0.22153 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4acy |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.269 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.6.0116) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.070 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.080 | 0.310 |
| Number of reflections | 45929 | |
| <I/σ(I)> | 12.6 | 2.3 |
| Completeness [%] | 92.1 | 76.6 |
| Redundancy | 2.6 | 2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 5.5 | 0.125 M AMMONIUM HYDROGEN CITRATE, 20% W/V PEG 3350, 0.1 M MES PH 5.5, 5 MM TCEP |
