6ABL
Crystal structure of Methanosarcina mazei PylRS(Y306A/Y384F) complexed with oBrZLys
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL32XU |
| Synchrotron site | SPring-8 |
| Beamline | BL32XU |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-07-22 |
| Detector | RAYONIX MX225-HS |
| Wavelength(s) | 1 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 101.671, 44.281, 72.654 |
| Unit cell angles | 90.00, 118.43, 90.00 |
Refinement procedure
| Resolution | 35.061 - 1.470 |
| R-factor | 0.1582 |
| Rwork | 0.157 |
| R-free | 0.19290 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2zim |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.461 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.13_2998: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.510 |
| High resolution limit [Å] | 1.470 | 1.470 |
| Rmeas | 0.066 | |
| Rpim | 0.032 | 0.252 |
| Number of reflections | 48022 | 2369 |
| <I/σ(I)> | 33 | |
| Completeness [%] | 98.9 | |
| Redundancy | 4.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 281 | Tris-HCl (pH 8.5), PEG 200, KCl, MgCl2, sodium citrate |
