3BB7
Structure of Prevotella intermedia prointerpain A fragment 39-359 (mutant C154A)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-09-16 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.9763 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 128.870, 38.810, 78.140 |
| Unit cell angles | 90.00, 127.26, 90.00 |
Refinement procedure
| Resolution | 39.070 - 1.500 |
| R-factor | 0.1556 |
| Rwork | 0.155 |
| R-free | 0.19338 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1dki |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.399 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 39.070 | 1.580 |
| High resolution limit [Å] | 1.500 | 1.500 |
| Rmerge | 0.080 | 0.409 |
| Number of reflections | 49377 | |
| <I/σ(I)> | 16.4 | 5.3 |
| Completeness [%] | 99.5 | 97.4 |
| Redundancy | 7 | 6.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 293 | 10% polyethylene glycol 3000, 0.2M magnesium chloride, 0.1M sodium cacodylate, pH6.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
