Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | CHESS BEAMLINE A1 |
Synchrotron site | CHESS |
Beamline | A1 |
Temperature [K] | 100 |
Collection date | 2005-11-05 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 195.192, 100.153, 80.189 |
Unit cell angles | 90.00, 105.45, 90.00 |
Refinement procedure
Resolution | 50.000 - 3.300 |
Rwork | 0.262 |
R-free | 0.33020 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2OVK |
RMSD bond length | 0.012 |
RMSD bond angle | 2.111 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | AMoRE |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 50.000 |
High resolution limit [Å] | 3.300 |
Rmerge | 0.123 |
Number of reflections | 21926 |
<I/σ(I)> | 16.5 |
Completeness [%] | 97.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.6 | 277 | 8% PEG 5000 MME, 150MM NACL, 100MM HEPES, 5% ETHYLENE GLYCOL, 5MM MGAC2, 2MM CAAC2, 2MM NAN3, 2MM BETA-MERCAPTOETHANOL, 20MM (NH4)2SO4, PH 7.6, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 277K |