5M3Q
Crystal structure of Tif6 from Chaetomium thermophilum
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-2 |
| Synchrotron site | ESRF |
| Beamline | ID23-2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-10-27 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 0.8726 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 54.350, 63.372, 78.665 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 41.256 - 1.500 |
| R-factor | 0.1514 |
| Rwork | 0.150 |
| R-free | 0.17680 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1g62 |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.569 |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.5.17) |
| Phasing software | MOLREP |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 44.720 | 44.720 | 1.530 |
| High resolution limit [Å] | 1.500 | 8.220 | 1.500 |
| Rmerge | 0.063 | 0.027 | 0.610 |
| Rmeas | 0.070 | 0.031 | 0.725 |
| Rpim | 0.031 | 0.015 | 0.384 |
| Total number of observations | 212576 | 1250 | 6305 |
| Number of reflections | 43931 | ||
| <I/σ(I)> | 16.8 | 38.1 | 2.4 |
| Completeness [%] | 99.3 | 98.4 | 94.2 |
| Redundancy | 4.8 | 3.9 | 3.1 |
| CC(1/2) | 0.999 | 0.998 | 0.645 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5.6 | 291 | 0.1 M Na-citrate pH 5.6 0.5 M Ammonium sulfate 1 M Lithium sulfate |
