3FP0
Structural and Functional Characterization of TRI3 Trichothecene 15-O-acetyltransferase from Fusarium sporotrichioides
Experimental procedure
Experimental method | MAD |
Source type | ROTATING ANODE |
Source details | RIGAKU RU200 |
Synchrotron site | APS |
Beamline | 19-BM |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-03-06 |
Detector | Bruker Platinum 135 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 64.282, 81.987, 95.436 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 62.140 - 1.900 |
R-factor | 0.18319 |
Rwork | 0.180 |
R-free | 0.23538 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3fot |
RMSD bond length | 0.016 |
RMSD bond angle | 1.654 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | SOLVE |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 62.200 | 2.000 |
High resolution limit [Å] | 1.900 | 1.900 |
Number of reflections | 40098 | |
<I/σ(I)> | 1.9 | |
Completeness [%] | 98.0 | 90 |
Redundancy | 4.96 | 2.35 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 277 | 2M Ammonium sulfate, 100 mM HEPES, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 277K |