4PIT
Crystal Structure of Banana Lectin H84T bound to dimannose
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-D |
| Synchrotron site | APS |
| Beamline | 21-ID-D |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-07-24 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 1.07820 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 50.613, 94.963, 63.054 |
| Unit cell angles | 90.00, 97.60, 90.00 |
Refinement procedure
| Resolution | 36.820 - 1.550 |
| R-factor | 0.1703 |
| Rwork | 0.169 |
| R-free | 0.19130 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.100 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER |
| Refinement software | BUSTER-TNT (2.10.0) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 1.580 |
| High resolution limit [Å] | 1.550 | 4.210 | 1.550 |
| Rmerge | 0.044 | 0.022 | 0.196 |
| Total number of observations | 315212 | ||
| Number of reflections | 85529 | ||
| <I/σ(I)> | 14.5 | ||
| Completeness [%] | 99.9 | 98.7 | 99.3 |
| Redundancy | 3.7 | 3.7 | 3.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 293.15 | 10-20% PEG 8000, 0.05M Potassium Phosphate |
