3KJJ
Crystal structure of NMB1025, a member of YjgF protein family, from Neisseria meningitidis (hexagonal crystal form)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM14 |
| Synchrotron site | ESRF |
| Beamline | BM14 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2005-11-14 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 0.97950 |
| Spacegroup name | P 63 |
| Unit cell lengths | 155.613, 155.613, 116.189 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 29.880 - 1.900 |
| R-factor | 0.1678 |
| Rwork | 0.166 |
| R-free | 0.20629 |
| Structure solution method | SAD |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.077 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | SOLVE |
| Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 1.970 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmerge | 0.154 | 0.758 |
| Number of reflections | 126653 | |
| <I/σ(I)> | 31.2 | 3.2 |
| Completeness [%] | 100.0 | 99.9 |
| Redundancy | 27.4 | 15.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 294 | VAPOR DIFFUSION, SITTING DROP, temperature 294K, pH 7.0 |
