1TFF
Structure of Otubain-2
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE BM30A |
Synchrotron site | ESRF |
Beamline | BM30A |
Temperature [K] | 105 |
Detector technology | CCD |
Detector | MARRESEARCH |
Wavelength(s) | 0.97630, 0.97990, 0.98010 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 46.433, 65.401, 76.259 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 49.390 - 2.100 |
R-factor | 0.19125 |
Rwork | 0.188 |
R-free | 0.25689 |
Structure solution method | MAD |
RMSD bond length | 0.028 |
RMSD bond angle | 2.382 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | SHARP |
Refinement software | REFMAC (5.1.24) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 100.000 | 2.180 |
High resolution limit [Å] | 2.100 | 2.100 |
Rmerge | 0.085 | |
Number of reflections | 14128 | |
<I/σ(I)> | 18.11 | 5.3 |
Completeness [%] | 99.7 | 100 |
Redundancy | 27 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 288.15 | 14% PEG 4000, 0.1 M HEPES, pH 7.0, 12 % isopropanol and 5 mM DTT., VAPOR DIFFUSION, HANGING DROP, temperature 288.15K |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 288.15 | 14% PEG 4000, 0.1 M HEPES, pH 7.0, 12 % isopropanol and 5 mM DTT., VAPOR DIFFUSION, HANGING DROP, temperature 288.15K |