Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL11-1 |
Synchrotron site | SSRL |
Beamline | BL11-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2001-11-16 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.9759 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 76.821, 94.182, 171.112 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 18.739 - 2.200 |
R-factor | 0.199 |
Rwork | 0.198 |
R-free | 0.22740 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1fvd |
RMSD bond length | 0.003 |
RMSD bond angle | 0.704 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | PHENIX ((1.12_2829)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 18.739 | 2.240 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.061 | 0.270 |
Number of reflections | 59743 | 2672 |
<I/σ(I)> | 32.9 | 4.2 |
Completeness [%] | 93.8 | 85.6 |
Redundancy | 3.1 | 2.96 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6 | 298 | 1.05M ammonium sulfate, 18% Peg 6000, 0.1M imidazole malate |