5IHS
Structure of CHU_2103 from Cytophaga hutchinsonii
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-G |
| Synchrotron site | APS |
| Beamline | 21-ID-G |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2015-06-15 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 0.97857 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 46.510, 70.210, 46.850 |
| Unit cell angles | 90.00, 118.03, 90.00 |
Refinement procedure
| Resolution | 26.681 - 1.100 |
| R-factor | 0.1181 |
| Rwork | 0.117 |
| R-free | 0.13160 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3pzt |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.990 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | BALBES |
| Refinement software | PHENIX ((1.10_2148: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 1.140 |
| High resolution limit [Å] | 1.100 | 1.100 |
| Rmerge | 0.070 | 0.365 |
| Number of reflections | 106696 | |
| <I/σ(I)> | 19.2 | 4 |
| Completeness [%] | 98.6 | 89.8 |
| Redundancy | 4.4 | 3.3 |
| CC(1/2) | 0.997 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 289 | crystals were obtained by the hanging drop vapor diffusion method from 30% polyethylene glycol monomethyl ether 2000 (PEG MME 2000), 0.15 M KBr with microseeds |
