7NRA
The structure of the SBP TarP_Sse in complex with cinnamate
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-05-25 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.9500 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 64.120, 70.200, 85.010 |
| Unit cell angles | 90.00, 93.12, 90.00 |
Refinement procedure
| Resolution | 64.020 - 1.910 |
| Rwork | 0.200 |
| R-free | 0.26080 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 7nr2 |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.509 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 64.020 | 1.960 |
| High resolution limit [Å] | 1.910 | 1.910 |
| Rmerge | 0.092 | 0.559 |
| Rpim | 0.079 | 0.410 |
| Number of reflections | 57762 | 4328 |
| <I/σ(I)> | 9.9 | 2.1 |
| Completeness [%] | 98.6 | 99.8 |
| Redundancy | 3.2 | 3.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 290 | 1.6 M tri-sodium citrate |
