1UIR
Crystal Structure of Polyamine Aminopropyltransfease from Thermus thermophilus
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE AR-NW12A |
Synchrotron site | Photon Factory |
Beamline | AR-NW12A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2003-05-25 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 1.000 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 87.775, 87.775, 190.825 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 39.870 - 2.000 |
R-factor | 0.199 |
Rwork | 0.199 |
R-free | 0.23900 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1inl |
RMSD bond length | 0.008 |
RMSD bond angle | 1.500 |
Data reduction software | MOSFLM |
Data scaling software | CCP4 ((SCALA)) |
Phasing software | EPMR |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 39.840 | 2.110 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.035 | 0.159 |
Number of reflections | 49522 | |
<I/σ(I)> | 15.6 | 5.1 |
Completeness [%] | 96.7 | 85 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | Ammonium sulfate, MES, Norspermidine, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |