2FD4
Crystal Structure of AvrPtoB (436-553)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X9A |
| Synchrotron site | NSLS |
| Beamline | X9A |
| Temperature [K] | 103 |
| Detector technology | CCD |
| Collection date | 2004-10-20 |
| Detector | MARRESEARCH |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 61.863, 61.863, 60.419 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 50.000 - 1.800 |
| R-factor | 0.24344 |
| Rwork | 0.242 |
| R-free | 0.26669 |
| Structure solution method | SAD |
| RMSD bond length | 0.019 |
| RMSD bond angle | 1.794 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | SOLVE (2.08) |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 99.000 | 1.760 |
| High resolution limit [Å] | 1.700 | 3.660 | 1.700 |
| Rmerge | 0.030 | 0.022 | 0.674 |
| Number of reflections | 15065 | ||
| Completeness [%] | 99.9 | 99.3 | 99.9 |
| Redundancy | 5.6 | 5.1 | 5.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.8 | 298 | 1.37 M-1.39 M sodium citrate, 100 mM HEPES, 2 mM DTT, pH 6.8, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
