3H37
The structure of CCA-adding enzyme apo form I
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL41XU |
Synchrotron site | SPring-8 |
Beamline | BL41XU |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2004-12-07 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.97940, 0.97952, 0.98200 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 190.569, 62.738, 152.390 |
Unit cell angles | 90.00, 103.96, 90.00 |
Refinement procedure
Resolution | 48.644 - 2.850 |
R-factor | 0.2319 |
Rwork | 0.230 |
R-free | 0.26650 |
Structure solution method | MAD |
RMSD bond length | 0.009 |
RMSD bond angle | 1.310 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | SHARP |
Refinement software | PHENIX ((phenix.refine)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.900 |
High resolution limit [Å] | 2.850 | 2.850 |
Number of reflections | 40434 | |
<I/σ(I)> | 40.2 | 3.7 |
Completeness [%] | 97.9 | 91.7 |
Redundancy | 5.1 | 3.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.4 | 293 | 20% ethylene glycol, 0.05M Tris-Cl pH8.4, VAPOR DIFFUSION, HANGING DROP, temperature 293K |