1PC9
Crystal Structure of BnSP-6, a Lys49-Phospholipase A2
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | LNLS BEAMLINE D03B-MX1 |
| Synchrotron site | LNLS |
| Beamline | D03B-MX1 |
| Temperature [K] | 283 |
| Detector technology | IMAGE PLATE |
| Collection date | 1999-02-04 |
| Detector | MARRESEARCH |
| Wavelength(s) | 1.38 |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 57.670, 57.670, 130.130 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 26.400 - 2.500 |
| Rwork | 0.186 |
| R-free | 0.25500 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | BthTX-I (closed form) |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.400 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | AMoRE |
| Refinement software | CNS |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 2.600 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.136 | 0.463 |
| Number of reflections | 8429 | |
| <I/σ(I)> | 8.6 | 1.6 |
| Completeness [%] | 91.1 | 90.2 |
| Redundancy | 11.3 | 3.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 291 | PEG 6000, ammonium sulphate, sodium cacodilate., pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 291K |
