5GZZ
Crystal Structure of FIN219-SjGST complex with JA
Experimental procedure
| Experimental method | LAUE |
| Source type | SYNCHROTRON |
| Source details | NSRRC BEAMLINE BL13C1 |
| Synchrotron site | NSRRC |
| Beamline | BL13C1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-03-30 |
| Detector | RAYONIX MX-300 |
| Wavelength(s) | 0.97620-0.97622 |
| Spacegroup name | P 1 |
| Unit cell lengths | 57.274, 91.802, 91.728 |
| Unit cell angles | 89.99, 89.99, 89.93 |
Refinement procedure
| Resolution | 26.209 - 2.386 |
| R-factor | 0.2067 |
| Rwork | 0.204 |
| R-free | 0.23360 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4epl |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.481 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER (2.5.6) |
| Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 2.490 |
| High resolution limit [Å] | 2.400 | 5.170 | 2.400 |
| Rmerge | 0.050 | 0.028 | 0.439 |
| Total number of observations | 141298 | ||
| Number of reflections | 73703 | ||
| <I/σ(I)> | 10.1 | ||
| Completeness [%] | 97.5 | 96 | 97.5 |
| Redundancy | 1.9 | 2 | 1.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 8.5 | 297 | 0.2 M Magnesium chloride hexahydrate, 0.1 M Tris-HCl, 40%(w/v) PEG 4000 |
