4C7J
11b-Hydroxysteroid Dehydrogenase Type I in complex with inhibitor
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU FR-E+ |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2011-05-17 |
Detector | RAXIS HTC |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 95.686, 98.435, 99.112 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 68.610 - 2.160 |
R-factor | 0.17718 |
Rwork | 0.174 |
R-free | 0.23956 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.014 |
RMSD bond angle | 1.646 |
Data reduction software | MOSFLM |
Data scaling software | XDS |
Phasing software | MOLREP |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 33.040 | 2.220 |
High resolution limit [Å] | 2.160 | 2.160 |
Rmerge | 0.120 | 0.550 |
Number of reflections | 50932 | |
<I/σ(I)> | 9.7 | 2.4 |
Completeness [%] | 100.0 | 100 |
Redundancy | 3.9 | 3.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 |