3FRR
Structure of human IST1(NTD) - (residues 1-189)(P21)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 HF |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2008-08-11 |
Detector | RIGAKU RAXIS IV |
Wavelength(s) | 1.54 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 29.251, 92.364, 33.251 |
Unit cell angles | 90.00, 97.02, 90.00 |
Refinement procedure
Resolution | 46.180 - 1.800 |
R-factor | 0.197 |
Rwork | 0.195 |
R-free | 0.24700 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2gd5 |
RMSD bond length | 0.011 |
RMSD bond angle | 1.347 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.860 |
High resolution limit [Å] | 1.800 | 1.800 |
Rmerge | 0.053 | 0.163 |
Number of reflections | 15886 | |
<I/σ(I)> | 19.209 | 4.5 |
Completeness [%] | 97.2 | 79.1 |
Redundancy | 3.1 | 1.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.6 | 296 | 35% pentaethritol propexylate 180mM KCl 50 mM HEPES, pH 7.6 7% ethylene glycol, VAPOR DIFFUSION, SITTING DROP, temperature 296K |