1YCI
Factor inhibiting HIF-1 alpha in complex with N-(carboxycarbonyl)-D-phenylalanine
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SRS BEAMLINE PX10.1 |
Synchrotron site | SRS |
Beamline | PX10.1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2004-11-10 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 1.488 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 86.853, 86.853, 150.519 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 43.450 - 2.700 |
R-factor | 0.21 |
Rwork | 0.210 |
R-free | 0.24400 |
Structure solution method | ISOMORPHOUS WITH 1H2N |
Starting model (for MR) | 1h2n |
RMSD bond length | 0.010 |
RMSD bond angle | 1.200 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 43.450 | 2.800 |
High resolution limit [Å] | 2.700 | 2.700 |
Rmerge | 0.082 | 0.446 |
Number of reflections | 16510 | |
<I/σ(I)> | 19.2 | 4.9 |
Completeness [%] | 99.9 | 100 |
Redundancy | 7.1 | 7.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 298 | 1.2M AMMONIUM SULPHATE, 4% PEG400, 0.1M HEPES PH7.5 ARGON ATMOSPHERE, 28MG/ML PROTEIN WITH 1MM FE(II), 10MM N-(CARBOXYCARBONYL)-D-PHENYLALANINE, VAPOR DIFFUSION, HANGING DROP, temperature 298.0K |