5AIV
Complex of human hematopoietic prostagandin D2 synthase (hH-PGDS) in complex with an active site inhibitor.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-08-30 |
| Spacegroup name | I 41 |
| Unit cell lengths | 124.020, 124.020, 106.530 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 29.230 - 2.040 |
| R-factor | 0.20489 |
| Rwork | 0.203 |
| R-free | 0.24635 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | NONE |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.032 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 29.910 | 2.090 |
| High resolution limit [Å] | 2.040 | 2.040 |
| Rmerge | 0.110 | 0.590 |
| Number of reflections | 51254 | |
| <I/σ(I)> | 14.2 | 2.8 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 6.7 | 5.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 |
