3UXA
Designed protein KE59 R1 7/10H
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU300 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2009-12-15 |
Detector | RIGAKU RAXIS IV++ |
Wavelength(s) | 1.5418 |
Spacegroup name | P 31 |
Unit cell lengths | 61.860, 61.860, 119.435 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 27.465 - 2.500 |
R-factor | 0.21587 |
Rwork | 0.212 |
R-free | 0.28358 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3uyc |
RMSD bond length | 0.016 |
RMSD bond angle | 1.648 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 27.465 | 2.540 |
High resolution limit [Å] | 2.500 | 2.500 |
Rmerge | 0.159 | 0.700 |
Number of reflections | 17470 | |
<I/σ(I)> | 9.7 | 2.2 |
Completeness [%] | 98.3 | 99.4 |
Redundancy | 3.9 | 4.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5 | 277 | 0.2 M ammonium chloride, 0.1 M sodium acetate, pH 5.0, 20% PEG6000, 3-(1-Methylpiperidinum)-1-propane-sulfonate, VAPOR DIFFUSION, SITTING DROP, temperature 277K |