2OK9
PrTX-I-BPB
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | LNLS BEAMLINE D03B-MX1 |
| Synchrotron site | LNLS |
| Beamline | D03B-MX1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-08-15 |
| Detector | MAR CCD 165 mm |
| Wavelength(s) | 1.427 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 38.602, 70.002, 43.787 |
| Unit cell angles | 90.00, 102.64, 90.00 |
Refinement procedure
| Resolution | 20.670 - 2.340 |
| R-factor | 0.223 |
| Rwork | 0.223 |
| R-free | 0.25200 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1pao |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.400 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | AMoRE |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.000 | 2.420 |
| High resolution limit [Å] | 2.340 | 2.340 |
| Rmerge | 0.106 | 0.383 |
| Number of reflections | 9854 | |
| <I/σ(I)> | 9.44 | 1.95 |
| Completeness [%] | 98.6 | 94 |
| Redundancy | 2.9 | 2.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.8 | 291 | 23% PEG 4000, 20% 2-propanol, 0.1M sodium citrate, pH 5.8, VAPOR DIFFUSION, HANGING DROP, temperature 291K |
