Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-4 |
| Synchrotron site | ESRF |
| Beamline | ID14-4 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2002-02-02 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 0.9393 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 94.910, 69.260, 147.210 |
| Unit cell angles | 90.00, 107.00, 90.00 |
Refinement procedure
| Resolution | 20.110 - 2.040 |
| R-factor | 0.18815 |
| Rwork | 0.186 |
| R-free | 0.22283 |
| Structure solution method | MAD |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.806 |
| Data reduction software | HKL-2000 |
| Data scaling software | XDS |
| Phasing software | SHARP |
| Refinement software | REFMAC (5.6.0046) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 2.160 |
| High resolution limit [Å] | 2.000 | 2.000 |
| <I/σ(I)> | 0.074 | 2.3 |
| Completeness [%] | 95.3 | 79.4 |
| Redundancy | 2.5 | 2.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 291 | 20% PEG 4000, 100 mM Na-citrate, 0.2 M NaCl, 5% (v/v) 2-propanol, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 291.0K |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 291 | 20% PEG 4000, 100 mM Na-citrate, 0.2 M NaCl, 5% (v/v) 2-propanol, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 291.0K |
