1BQK
OXIDIZED PSEUDOAZURIN
Experimental procedure
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE BL-6A |
| Synchrotron site | Photon Factory |
| Beamline | BL-6A |
| Temperature [K] | 293 |
| Detector technology | IMAGE PLATE |
| Collection date | 1993-06-25 |
| Detector | FUJI |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 56.731, 61.544, 30.083 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 8.000 - 1.350 |
| R-factor | 0.176 |
| Rwork | 0.178 |
| R-free | 0.19000 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1pza |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.022 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | AMoRE |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 * | 1.400 |
| High resolution limit [Å] | 1.350 | 1.350 |
| Rmerge | 0.085 | 0.182 |
| Total number of observations | 222685 * | |
| Number of reflections | 21303 | |
| <I/σ(I)> | 8 | |
| Completeness [%] | 88.8 | 56 |
| Redundancy | 10.5 | 3.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Vapor diffusion, hanging drop * | 6 | 4 * | Inoue, T., (1993) J.Biochem.(Tokyo), 114, 761. * |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | drop | protein | 10 (mg/ml) | |
| 2 | 1 | drop | sodium cacodylate | 0.1 (M) | |
| 3 | 1 | drop | sodium azide | 1 (mM) | |
| 4 | 1 | drop | ammonium sulfate | 50 (%sat) | |
| 5 | 1 | reservoir | sodium cacodylate | 0.1 (M) | |
| 6 | 1 | reservoir | sodium azide | 1 (mM) | |
| 7 | 1 | reservoir | PEG8000 | 5 (%(w/v)) | |
| 8 | 1 | reservoir | ammonium sulfate | 70 (%sat) |
