5E85
isolated SBD of BiP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X4C |
| Synchrotron site | NSLS |
| Beamline | X4C |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-02-08 |
| Detector | MAR CCD 165 mm |
| Wavelength(s) | 0.979 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 36.378, 91.661, 141.797 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 38.489 - 2.570 |
| R-factor | 0.2215 |
| Rwork | 0.219 |
| R-free | 0.26400 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.746 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.8.1_1168) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 38.490 | 2.610 |
| High resolution limit [Å] | 2.570 | 2.570 |
| Rmerge | 0.044 | 0.120 |
| Number of reflections | 7908 | |
| <I/σ(I)> | 56.6 | 16.2 |
| Completeness [%] | 99.8 | 98 |
| Redundancy | 6.6 | 4.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 4.5 | 297 | 2.0 M ammonium sulfate, 0.1 M acetate acid, pH 4.5, and 2.67% acetonitrile |
