4AAW
S.pneumoniae GlmU in complex with an antibacterial inhibitor
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-1 |
| Synchrotron site | ESRF |
| Beamline | ID23-1 |
| Temperature [K] | 287 |
| Detector technology | CCD |
| Collection date | 2006-04-28 |
| Detector | ADSC CCD |
| Spacegroup name | P 3 2 1 |
| Unit cell lengths | 116.779, 116.779, 116.683 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 76.470 - 2.200 |
| R-factor | 0.20164 |
| Rwork | 0.200 |
| R-free | 0.23662 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1g97 |
| RMSD bond length | 0.020 |
| RMSD bond angle | 2.110 |
| Data reduction software | d*TREK |
| Data scaling software | d*TREK |
| Phasing software | AMoRE |
| Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 76.500 | 2.320 |
| High resolution limit [Å] | 2.200 | 2.200 |
| Rmerge | 0.260 | 0.610 |
| Number of reflections | 74324 | |
| <I/σ(I)> | 2.2 | 1.1 |
| Completeness [%] | 99.0 | 98 |
| Redundancy | 4.4 | 4.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7.5 | 18-23% PEG 3350, 0.2 M AMMONIUM SULPHATE, 25 MM TRIS-HCL, PH 7.5, 50 MM NACL, 2 MM TCEP |
