2BEL
Structure of human 11-beta-hydroxysteroid dehydrogenase in complex with NADP and carbenoxolone
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06SA |
| Synchrotron site | SLS |
| Beamline | X06SA |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2004-11-02 |
| Detector | MARRESEARCH |
| Spacegroup name | P 21 21 2 |
| Unit cell lengths | 160.162, 112.984, 66.326 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 56.520 - 2.110 |
| R-factor | 0.19 |
| Rwork | 0.188 |
| R-free | 0.24600 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | UNPUBLISHED MODEL OF HUMAN 11BETA HSD1 |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.607 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 61.080 | 2.210 |
| High resolution limit [Å] | 2.100 | 2.100 |
| Rmerge | 0.090 | 0.380 |
| Number of reflections | 68824 | |
| <I/σ(I)> | 12.6 | 2.1 |
| Completeness [%] | 97.1 | 84.6 |
| Redundancy | 4.7 | 2.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 5.5 | 0.1 M MGCL2, 15% PEG 3350,, pH 5.50 |
