5CI8
Crystal structure of human Tob in complex with inhibitor fragment 1
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17U |
Synchrotron site | SSRF |
Beamline | BL17U |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2014-01-20 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 1.0 |
Spacegroup name | P 61 2 2 |
Unit cell lengths | 64.975, 64.975, 163.677 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 39.170 - 2.328 |
R-factor | 0.2379 |
Rwork | 0.232 |
R-free | 0.28470 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.008 |
RMSD bond angle | 1.044 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 50.000 |
High resolution limit [Å] | 2.310 |
Number of reflections | 8867 |
<I/σ(I)> | 52.6 |
Completeness [%] | 94.4 |
Redundancy | 12.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5 | 293 | 0.1 M Citric acid pH 5.0, 3.0 M Sodium chloride, 5% DMSO |