2W0V
Crystal structure of Glmu from Haemophilus influenzae in complex with quinazoline inhibitor 1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 17-ID |
| Synchrotron site | APS |
| Beamline | 17-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2004-03-01 |
| Detector | ADSC QUANTUM 210 |
| Spacegroup name | H 3 2 |
| Unit cell lengths | 108.821, 108.821, 326.850 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 111.800 - 1.990 |
| R-factor | 0.2 |
| Rwork | 0.198 |
| R-free | 0.23200 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2v0h |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.111 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.1.24) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 2.070 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.060 | 0.400 |
| Number of reflections | 46320 | |
| <I/σ(I)> | 22.36 | 2.47 |
| Completeness [%] | 90.5 | 87.3 |
| Redundancy | 5.52 | 5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 1.7 M AMMONIUM SULFATE, 2% PEG 400, 0.1M MES PH 5.4-6.1. |
