3HN1
Crystal structure of HCR/T complexed with GT2 and lactose
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2008-11-06 |
| Detector | RIGAKU RAXIS IV++ |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 66.970, 72.680, 119.440 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 25.530 - 2.100 |
| R-factor | 0.216 |
| Rwork | 0.216 |
| R-free | 0.25700 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | PDB 3HMY |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.300 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | CNS |
| Refinement software | CNS |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 25.530 | 2.180 |
| High resolution limit [Å] | 2.100 | 2.100 |
| Number of reflections | 34207 | |
| <I/σ(I)> | 18.4 | 2.6 |
| Completeness [%] | 98.2 | 96.3 |
| Redundancy | 7 | 6.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 292 | Bis-Tris propane, PEG2K and ammonium sulfate, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 292K |
