2CGO
FACTOR INHIBITING HIF-1 ALPHA with fumarate
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X25 |
Synchrotron site | NSLS |
Beamline | X25 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-08-28 |
Detector | ADSC CCD |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 86.660, 86.660, 147.349 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 74.740 - 2.300 |
R-factor | 0.192 |
Rwork | 0.187 |
R-free | 0.23700 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1h2k |
RMSD bond length | 0.026 |
RMSD bond angle | 2.012 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 37.500 | 2.380 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.070 | |
Number of reflections | 888919 | |
<I/σ(I)> | 28.7 | 2.9 |
Completeness [%] | 99.7 | 100 |
Redundancy | 13.9 | 13.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7.5 | 1.25M AMMONIUM SULFATE, 100MM HEPES PH7.5, 6% PEG400, 1MM IRON (II) SULFATE, 20MM FUMARIC ACID, pH 7.50 |