3VVE
Crystal structure of TTC0807 complexed with Lysine
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] | 95 |
Detector technology | CCD |
Collection date | 2010-10-09 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 1.0 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 68.844, 71.965, 105.838 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 27.310 - 2.000 |
R-factor | 0.2037 |
Rwork | 0.201 |
R-free | 0.25991 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1lst |
RMSD bond length | 0.012 |
RMSD bond angle | 1.477 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 27.310 | 2.051 |
High resolution limit [Å] | 2.000 | 2.000 |
Number of reflections | 36243 | |
Completeness [%] | 99.9 | 100 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 293 | 0.2M Ammonium sulfate, 20% PEG4000, 10mM Lysine, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K |