4DDA
EVAL processed HEWL, NAG
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2011-02-01 |
| Detector | RIGAKU RAXIS IV |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 78.378, 78.378, 36.581 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 19.590 - 2.480 |
| R-factor | 0.20401 |
| Rwork | 0.200 |
| R-free | 0.28508 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2w1y |
| RMSD bond length | 0.013 |
| RMSD bond angle | 2.377 |
| Data reduction software | EVAL15 (15) |
| Data scaling software | EVAL15 (15) |
| Phasing software | PHASER (MR) |
| Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 19.590 | 2.480 |
| High resolution limit [Å] | 2.400 | 2.400 |
| Rmerge | 0.147 | 0.607 |
| Number of reflections | 3494 | |
| <I/σ(I)> | 13.6 | 4.02 |
| Completeness [%] | 84.8 | 97.3 |
| Redundancy | 12.1 | 12.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | BATCH | 4.7 | 295 | HEWL co-crystallized with 150 mM excess N-acetylglucosamine in 1 mL 0.05 M sodium acetate and 1 mL 10% sodium chloride, pH 4.7, BATCH, temperature 295K |
