5MT8
Structure of E.coli GlpG in complex with peptide derived inhibitor Ac-RVRHA-cmk
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I02 |
| Synchrotron site | Diamond |
| Beamline | I02 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-11-25 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.9794 |
| Spacegroup name | H 3 2 |
| Unit cell lengths | 111.159, 111.159, 124.553 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 44.900 - 1.950 |
| R-factor | 0.20075 |
| Rwork | 0.200 |
| R-free | 0.22507 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2xov |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.307 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 44.900 | 2.000 |
| High resolution limit [Å] | 1.950 | 1.950 |
| Rmerge | 0.031 | 1.000 |
| Number of reflections | 21621 | |
| <I/σ(I)> | 24.5 | 1.6 |
| Completeness [%] | 99.6 | 95.5 |
| Redundancy | 6.5 | 6 |
| CC(1/2) | 0.998 | 0.593 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 295 | 2M Sodium cholride |
