7KMV
Structure of Malaysian Banana Lectin F84T
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-G |
| Synchrotron site | APS |
| Beamline | 21-ID-G |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2017-10-19 |
| Detector | RAYONIX MX300HE |
| Wavelength(s) | 0.9786 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 79.247, 157.871, 204.101 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 49.060 - 1.800 |
| R-factor | 0.199 |
| Rwork | 0.198 |
| R-free | 0.23000 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2bmy |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.070 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | BUSTER (2.10.3) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 1.830 |
| High resolution limit [Å] | 1.800 | 4.880 | 1.800 |
| Rmerge | 0.084 | 0.045 | 0.662 |
| Rmeas | 0.090 | 0.049 | 0.716 |
| Rpim | 0.034 | 0.019 | 0.271 |
| Total number of observations | 1657573 | ||
| Number of reflections | 234462 | 12306 | 11570 |
| <I/σ(I)> | 6.7 | ||
| Completeness [%] | 99.8 | 99.4 | 99.5 |
| Redundancy | 7.1 | 7 | 6.9 |
| CC(1/2) | 0.998 | 0.918 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 293.15 | 1.8M Ammonium Sulfate, 5% Peg 400, 0.1M MES 6.5 |
