6U0B
Neutron crystal structure of wtT4LD
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 HF |
Temperature [K] | 298 |
Detector technology | IMAGE PLATE |
Collection date | 2017-08-01 |
Detector | RIGAKU RAXIS IV++ |
Wavelength(s) | 1.5418 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 60.870, 60.870, 97.000 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 14.457 - 2.101 |
R-factor | 0.2204 |
Rwork | 0.219 |
R-free | 0.25100 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5vnq |
Data reduction software | Mantid |
Data scaling software | LaueView |
Phasing software | PHASER |
Refinement software | PHENIX (1.13_2998) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 35.000 | 2.180 | 2.020 |
High resolution limit [Å] | 1.950 | 2.100 | 1.950 |
Rmerge | 0.109 | 0.274 | 0.462 |
Number of reflections | 15677 | 846 | 1535 |
<I/σ(I)> | 16.7 | 2.68 | 4.7 |
Completeness [%] | 99.9 | ||
Redundancy | 5.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6 | 298 | ~2.0 M Na/K phosphate, pH 6-7, 250 mM NaCl |
1 | VAPOR DIFFUSION, SITTING DROP | 6 | 298 | ~2.0 M Na/K phosphate, pH 6-7, 250 mM NaCl |