3NC5
CYP134A1 structure with an open substrate binding loop
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X10SA |
Synchrotron site | SLS |
Beamline | X10SA |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-04-30 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 1.0000 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 63.800, 105.400, 143.900 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 40.620 - 2.900 |
R-factor | 0.23468 |
Rwork | 0.231 |
R-free | 0.30637 |
Structure solution method | SAD |
RMSD bond length | 0.009 |
RMSD bond angle | 1.254 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | SHARP |
Refinement software | REFMAC (5.5.0070) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.620 | 2.975 |
High resolution limit [Å] | 2.900 | 2.900 |
Rmerge | 0.120 | 0.340 |
Number of reflections | 21929 | |
<I/σ(I)> | 9.1 | 4.1 |
Completeness [%] | 95.8 | 90.3 |
Redundancy | 3.9 | 4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 0.1 M Bis-Tris, 0.1 M MgCl2, 12% (w/v) polyethylene glycol-3350, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |