1IRB
CARBOXYLIC ESTER HYDROLASE
Experimental procedure
| Temperature [K] | 291 |
| Detector technology | IMAGE PLATE |
| Collection date | 1995-10-26 |
| Detector | RIGAKU RAXIS IIC |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 46.810, 46.810, 102.890 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 8.000 - 1.900 |
| R-factor | 0.192 |
| Rwork | 0.192 |
| Starting model (for MR) | WILD TYPE (PDB ENTRY 2BPP) |
| RMSD bond length | 0.014 |
| RMSD bond angle | 22.960 * |
| Data reduction software | R-AXIS (IIC) |
| Data scaling software | R-AXIS (II) |
| Phasing software | X-PLOR |
| Refinement software | X-PLOR |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 15.000 | 2.000 |
| High resolution limit [Å] | 1.700 | 1.900 |
| Rmerge | 0.075 | 0.220 |
| Number of reflections | 10032 | |
| <I/σ(I)> | 2.3 | |
| Completeness [%] | 8.0 | 56 |
| Redundancy | 2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.2 | CRYSTALS WERE GROWN BY THE HANGING DROP VAPOR DIFFUSION METHOD USING THE CONDITIONS DESCRIBED FOR THE WILD TYPE ENZYME (NOEL ET AL., 1991), pH 7.2, vapor diffusion - hanging drop |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | 1 | Tris | 50 (mM) | |
| 2 | 1 | 1 | 5 (mM) | ||
| 3 | 1 | 1 | lyophillized PLA2 | 10-15 (mg/ml) |
