3HCH
Structure of the C-terminal domain (MsrB) of Neisseria meningitidis PilB (complex with substrate)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-1 |
| Synchrotron site | ESRF |
| Beamline | ID14-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2004-10-01 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 0.934 |
| Spacegroup name | P 43 3 2 |
| Unit cell lengths | 154.879, 154.879, 154.879 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 14.830 - 2.100 |
| R-factor | 0.19785 |
| Rwork | 0.196 |
| R-free | 0.22578 |
| Starting model (for MR) | 3hcg |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.611 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | CNS |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.180 |
| High resolution limit [Å] | 2.100 | 2.100 |
| Number of reflections | 37516 | |
| <I/σ(I)> | 28.1 | 3 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 32.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | microbatch under oil | 8.5 | 293 | 30 % PEG 400, 0.1M TRIS HCl pH 8.5, 0.2M Na Citrate, 0.05M TRIS HCl pH 8, microbatch under oil, temperature 293K |
