6ANY
Structure of BmVAL-1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU FR-E+ SUPERBRIGHT |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2016-08-17 |
| Detector | RIGAKU |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 85.790, 85.790, 66.670 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 44.870 - 2.250 |
| R-factor | 0.18316 |
| Rwork | 0.180 |
| R-free | 0.21430 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1u53 |
| RMSD bond length | 0.020 |
| RMSD bond angle | 1.787 |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 60.660 | |
| High resolution limit [Å] | 2.250 | |
| Rmerge | 0.032 | 0.156 |
| Rmeas | 0.045 | 0.221 |
| Rpim | 0.032 | 0.156 |
| Number of reflections | 11799 | |
| <I/σ(I)> | 9.7 | |
| Completeness [%] | 96.4 | |
| Redundancy | 7.1 | |
| CC(1/2) | 0.998 | 0.927 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 298 | PEGS 2 #67 |
