2AHC
Chorismate lyase with inhibitor Vanilate
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 17-ID |
Synchrotron site | APS |
Beamline | 17-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2001-03-08 |
Detector | MARRESEARCH |
Wavelength(s) | 1.0 |
Spacegroup name | P 1 |
Unit cell lengths | 56.173, 58.560, 70.646 |
Unit cell angles | 70.24, 67.40, 67.17 |
Refinement procedure
Resolution | 8.000 - 2.400 |
R-factor | 0.262 |
Rwork | 0.262 |
R-free | 0.31400 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1fw9 |
RMSD bond length | 0.016 |
RMSD bond angle | 2.300 |
Data reduction software | DENZO |
Data scaling software | X-GEN |
Phasing software | CNS |
Refinement software | CNS (1.0) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 12.000 | 2.400 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.052 | 0.093 |
Number of reflections | 33472 | |
<I/σ(I)> | 18.3 | 6.3 |
Completeness [%] | 87.0 | 82 |
Redundancy | 2.1 | 1.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 295 | pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 295K |