4C7K
11b-Hydroxysteroid Dehydrogenase Type I in complex with inhibitor
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU FR-E+ SUPERBRIGHT |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2011-02-22 |
Detector | RIGAKU HTC |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 99.330, 99.250, 99.940 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 49.630 - 1.910 |
R-factor | 0.2424 |
Rwork | 0.240 |
R-free | 0.29050 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4bb5 |
RMSD bond length | 0.010 |
RMSD bond angle | 1.120 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | BUSTER (2.11.5) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 49.630 | 1.960 |
High resolution limit [Å] | 1.910 | 1.910 |
Rmerge | 0.090 | 0.440 |
Number of reflections | 74883 | |
<I/σ(I)> | 20.4 | 4.9 |
Completeness [%] | 96.1 | 87.9 |
Redundancy | 7.1 | 6.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 |