5T50
LIGAND-FREE LECTIN FROM BAUHINIA FORFICATA
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-ID |
Synchrotron site | APS |
Beamline | 22-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2015-09-05 |
Detector | RAYONIX MX300-HS |
Wavelength(s) | 1.0000 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 45.991, 58.004, 190.546 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 30.000 - 1.430 |
R-factor | 0.1186 |
Rwork | 0.116 |
R-free | 0.16050 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1hql |
RMSD bond length | 0.021 |
RMSD bond angle | 1.986 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 1.450 |
High resolution limit [Å] | 1.430 | 3.880 | 1.430 |
Rmerge | 0.059 | 0.026 | 0.488 |
Number of reflections | 90961 | ||
<I/σ(I)> | 8.4 | ||
Completeness [%] | 95.5 | 99.6 | 63.9 |
Redundancy | 4.7 | 4.8 | 2.5 |
CC(1/2) | 0.999 | 0.759 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | PROTEIN CONCENTRATION 5-8 MG/ML IN 0.05 M HEPES BUFFER (pH 7.5) AND 0.15 M NACL, PRECIPITANT: 12% (W/W) PEG8000, 8% (W/V) ETHYLENE GLYCOL, 0.1 M HEPES (pH 7.5), DROPLETS RATIO: 1:1 |